174 SMILES Strings for Ectonucleotide pyrophosphatase/phosphodiesterase family member 3

Compound Name
SMILES String
COc1ccc2nc(SCC(=O)Nc3ccc(OC)c(OC)c3)[nH]c2n1
c1ccc(cc1)CP(=O)(O)O
COc1ccc(cc1)-c1cccc2c(Cl)c(Br)c(nc12)C(F)(F)F
FC(F)(F)c1nc2c(Br)cccc2c(Cl)c1Br
Cc1ccc(cc1)-c1cccc2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(nc12)C(F)(F)F
FC(F)(F)c1nc2c(cccc2c(Cl)c1Br)-c1ccsc1
COc1ccc(cc1)-c1cccc2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)c(nc12)C(F)(F)F
Fc1ccc(cc1)-c1cccc2c(-c3ccc(F)cc3)c(-c3ccc(F)cc3)c(nc12)C(F)(F)F
Cc1cccc(c1)-c1cccc2c(-c3cccc(C)c3)c(-c3cccc(C)c3)c(nc12)C(F)(F)F
FC(F)(F)c1ccc(cc1)-c1cccc2c(Cl)c(Br)c(nc12)C(F)(F)F
FC(F)(F)c1nc2c(cccc2c(Cl)c1Br)-c1cccc(c1)C#N
FC(F)(F)c1nc2c(cccc2c(Cl)c1-c1ccccc1)-c1ccccc1
CC1=CCC(=C\C1=N\C(=O)C1=CC=C\C(C1)=N/C(=O)/N=C1/CC(=CC=C1)C(=O)\N=C1\CC(=CC=C1C)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O |c:4,13,24,26,34,36,45,72,t:1,11|
COc1ccc(OC)c(c1)-c1cccc2c(Cl)c(Br)c(nc12)C(F)(F)F
FC(F)(F)c1nc2c(cccc2c(-c2ccccc2)c1-c1ccccc1)-c1ccccc1
FC(F)(F)c1[nH]c2c(Br)cccc2c(=O)c1Br
Cc1nn(C(=O)c2ccccc2C)c(C)c1Cl
Cc1nn(C(=O)c2ccc(N)cc2)c(C)c1Cl
Cc1nn(C(=O)c2ccc(Cl)cc2)c(C)c1Cl
Cc1cc(C)n(n1)C(=O)c1ccc(Cl)cc1
Cc1cc(C)n(n1)C(=O)c1cccc(C)c1
Cc1cc(C)n(n1)C(=O)c1ccccc1C
Cc1cc(=O)n([nH]1)C(=O)c1ccc(C)cc1
Cc1cc(=O)n([nH]1)C(=O)c1ccc(N)cc1
Cc1nn(C(=O)c2ccc(Cl)cc2)c(C)c1Oc1ccc(C)cc1
Cc1n[nH]c(C)c1Oc1ccc2ccccc2c1
Cc1nn(C(=O)c2ccc3ccccc3c2)c(C)c1Cl
Cc1nn(C(=O)c2ccncc2)c(C)c1Cl
Cc1nn(C(=O)c2cccc(C)c2)c(C)c1Cl
CC(C)Cc1ccc(cc1)[C@@H](C)C(=O)n1nc(C)c(Cl)c1C |r|
Cc1cc(C)n(n1)C(=O)c1ccncc1
Cc1nn(C(=O)c2ccc(C)cc2)c(C)c1Cl
Cc1cc(C)n(n1)C(=O)c1ccc2ccccc2c1
Cc1cc(C)n(n1)C(=O)c1ccc(N)cc1
Cc1nn(C(=O)c2ccc(N)cc2)c(C)c1Oc1ccc(C)cc1
Cc1nn(C(=O)\C=C\c2ccccc2)c(C)c1Cl
CNS(=O)(=O)Oc1ccc(cc1)-c1sc2cc(OS(=O)(=O)NC)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
Fc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1sc2cc(OS(=O)(=O)c3ccc(F)cc3)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1sc2cc(OS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
COc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1sc2cc(OS(=O)(=O)c3ccc(OC)cc3)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
CCS(=O)(=O)Oc1ccc(cc1)-c1sc2cc(OS(=O)(=O)CC)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
CC(C)(C)c1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1sc2cc(OS(=O)(=O)c3ccc(cc3)C(C)(C)C)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1
O=C(c1c(sc2cc(OS(=O)(=O)C3CCCCC3)ccc12)-c1ccc(OS(=O)(=O)C2CCCCC2)cc1)c1ccc(OCCN2CCCCC2)cc1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCCCC2)cc1
CCCS(=O)(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCC2)cc1
CC(C)(C)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCC2)cc1
Fc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCC2)cc1
CS(=O)(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1
O=C(Nc1ccc(OS(=O)(=O)c2ccccc2)cc1)C1CCCCC1
Fc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1
O=C(Nc1ccc(OS(=O)(=O)c2ccccc2)cc1)C1CCCCCC1
CC(C)(C)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCCC2)cc1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCCC2)cc1
Clc1ccc(cc1)C(=O)Nc1ccc(OS(=O)(=O)c2ccccc2)cc1
CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
O=C(Nc1ccc(OS(=O)(=O)c2ccccc2)cc1)c1ccc2ccccc2c1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)c2ccc3ccccc3c2)cc1
CCS(=O)(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCCC2)cc1
O=C(Nc1ccc(OS(=O)(=O)c2ccccc2)cc1)C1CCCC1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCC2)cc1
CC(C)(C)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1
Fc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCCC2)cc1
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)Oc1ccc(NC(=O)c2ccc3ccccc3c2)cc1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1
Fc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)c2ccc3ccccc3c2)cc1
CC(C)(C)c1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
Cc1nc(co1)-c1ccc(cc1)-c1cccc2ccccc12
Cc1nc(co1)-c1ccc(cc1)-c1cccc(C)c1
Cc1nc(co1)-c1ccc(cc1)-c1ccc(C)cc1
COc1ccc(cc1)-c1ccc(cc1)-c1coc(C)n1
Cc1nc(co1)-c1ccc(cc1)-c1ccc(OCc2ccccc2)cc1
Cc1ccccc1-c1ccc(cc1)-c1coc(n1)-c1ccccc1
COc1ccc(cc1)-c1ccc(cc1)-c1coc(n1)-c1ccccc1
CCOc1ccccc1-c1nc(co1)-c1ccc(cc1)-c1ccc(C)cc1
Cc1cccc(c1)-c1ccc(cc1)-c1coc(n1)-c1ccccc1-c1cccc(C)c1
Oc1ccc(cc1Cl)-c1nn(cc1-c1ccncc1)-c1cccc(NC(=S)Nc2ccccc2)c1
Clc1ccc(cc1)S(=O)(=O)NC(=O)n1ccc2cccnc12
[O-][N+](=O)c1cccc(c1)S(=O)(=O)NC(=O)n1ccc2cccnc12
Cc1ccc(cc1)S(=O)(=O)NC(=O)n1ccc2cccnc12
Brc1cnc2n(ccc2c1)C(=O)NS(=O)(=O)c1ccccc1
[O-][N+](=O)c1cccc(c1)S(=O)(=O)NC(=O)n1ccc2cc(Br)cnc12
Cc1ccc(cc1)S(=O)(=O)NC(=O)n1ccc2cc(Br)cnc12
Brc1cnc2n(ccc2c1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
Clc1ccnc2n(ccc12)C(=O)NS(=O)(=O)c1ccccc1
Clc1ccnc2n(ccc12)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
CN(C)c1ccnc2n(ccc12)C(=O)NS(=O)(=O)c1ccccc1
Cc1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(c4)S(O)(=O)=O)n3)c(c2)S(O)(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S(O)(=O)=O
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccccc3)c3ccccc23)cc1
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccc(O)cc3)c3ccccc23)cc1
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccc(Cl)cc3)c3ccccc23)cc1
Cc1ccc(cc1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
COc1ccc(cc1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
CCOc1ccc(cc1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccc(OCC#C)cc3)c3ccccc23)cc1
NC(=O)c1ccc(cc1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
CCN(CC)C(=O)c1ccc(cc1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
NS(=O)(=O)c1ccc(Nc2nnc(-c3cccc(c3)S(N)(=O)=O)c3ccccc23)cc1
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccc(Cl)c(c3)S(N)(=O)=O)c3ccccc23)cc1
COc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccc(O)c(c3)S(N)(=O)=O)c3ccccc23)cc1
CNS(=O)(=O)c1cc(ccc1C)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
CN(C)S(=O)(=O)c1cc(ccc1C)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)NC(C)(C)C)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)NCCO)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)NC(C)(C)CO)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)NCc1ccccn1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)NCc1ccco1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)N1CCCCC1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1S(=O)(=O)N1CCOCC1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1cc(ccc1Nc1nnc(-c2ccc(C)c(c2)S(N)(=O)=O)c2ccccc12)S(N)(=O)=O
Cc1ccc(cc1C(N)=O)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1-c1nnco1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1-c1nccs1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(cc1-c1nnc[nH]1)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
CCc1nnc(s1)-c1cc(ccc1C)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Cc1ccc(Nc2nnc(-c3ccc(C)c(c3)S(N)(=O)=O)c3ccccc23)cc1
Cc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(Cl)cc2)c2ccccc12
Cc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(F)cc2)c2ccccc12
Cc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(O)cc2)c2ccccc12
Nc1ncnc2n(cnc12)[C@H](O[C@H](COP(O)(=O)OP(O)(O)=O)C=O)C=O |r|
[#6]-[#6]-[#7]-1-[#6](=S)-[#7](-[#6]-[#6])-[#6](=O)\[#6](=[#6]/c2cn(nc2-c2ccccc2)-c2ccccc2)-[#6]-1=O
N#Cc1ccc2n(ccc2c1)-c1cc2ccccc2c2cc3cc(ccc3n12)C#N
Cc1cc(C)cc(c1)-c1nn2c(nc(C)c(F)c2=O)s1
CCCC(Oc1cccc(C)c1)c1n[nH]c(=S)o1
O=C(Nc1ccc(OS(=O)(=O)c2ccccc2)cc1)C12CC3CC(CC(C3)C1)C2 |TLB:22:23:27:21.26.20,THB:24:23:26.25.27:20,24:25:28.23.22:20,22:21:27:28.23.24|
Fc1ccc(cc1)S(=O)(=O)Oc1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1 |TLB:21:22:26:20.25.19,THB:23:22:25.24.26:19,23:24:27.22.21:19,21:20:26:27.22.23|
O=c1ccc2c(N3C[C@@H]4[C@@H](CCP(=O)(O)O)[C@@H]4C3)ncnc2[nH]1
Cc1nc2ncnn2c(N(C)C)c1Cc1ccccc1
Cc1nc2ncnn2c(N(C)C)c1Cc1ccc(N)cc1
Cc1nc2ncnn2c(N(C)C)c1Cc1cccc(N)c1
Cc1cc(N(C)C)n2ncnc2n1
Cc1nc2ncnn2c(O)c1Cc1ccccc1
Cc1cc(O)n2ncnc2n1
Cc1nc2ncnn2c(N(C)C)c1CCc1ccccc1
Cc1nc2ncnn2c(N(C)C)c1Cc1cccc(-c2ccccc2)c1
Cc1nc2ncnn2c(N(C)C)c1CC1CCCCC1
Cc1nc2ncnn2c(N(C)C)c1Cc1ccc(Cl)cc1
Cc1nc2ncnn2c(N(C)C)c1Cc1ccccc1Cl
Cc1nc2ncnn2c(N(C)C)c1Cc1cccc(Cl)c1
Cc1nc2ncnn2c(N(C)C)c1Cc1cccc(F)c1
Cc1cccc(Cc2c(C)nc3ncnn3c2N(C)C)c1
Cc1nc2ncnn2c(N(C)C)c1Cc1ccc([N+](=O)[O-])cc1
CC(=O)Nc1ccc(Cc2c(C)nc3ncnn3c2N(C)C)cc1
Cc1nc2ncnn2c(N(C)C)c1Cc1cccc([N+](=O)[O-])c1
CC(=O)Nc1cccc(Cc2c(C)nc3ncnn3c2N(C)C)c1
Cc1nc2ncnn2c(N(C)C)c1Cc1ccccc1[N+](=O)[O-]
Cc1nc2ncnn2c2c1Cc1ccccc1N2
COc1ccc(Cc2c(C)nc3ncnn3c2N(C)C)cc1OC
COc1cccc(Cc2c(C)nc3ncnn3c2N(C)C)c1
Cc1nc2ncnn2c(N(C)C)c1Cc1cccc(O)c1
Cc1nc2ncnn2c(NCc2cccnc2)c1Cc1cccc(N)c1
Cc1nc2ncnn2c(NCc2ccccc2)c1Cc1cccc(N)c1
Cc1nc2ncnn2c(N(C)Cc2ccccc2)c1Cc1cccc(N)c1
Cc1nc2ncnn2c(NCc2ccc(C(=O)O)cc2)c1Cc1cccc(N)c1
Cc1nc2ncnn2c(NCCCC(=O)O)c1Cc1cccc(N)c1
Cc1nc2ncnn2c(NCCCCC(=O)O)c1Cc1cccc(N)c1
CNc1c(Cc2ccccc2)c(C)nc2ncnn12
CCNc1c(Cc2ccccc2)c(C)nc2ncnn12
CCN(CC)c1c(Cc2ccccc2)c(C)nc2ncnn12
CCCNc1c(Cc2ccccc2)c(C)nc2ncnn12
CCCN(CCC)c1c(Cc2ccccc2)c(C)nc2ncnn12
Cc1nc2ncnn2c(NCCO)c1Cc1ccccc1
COCCNc1c(Cc2ccccc2)c(C)nc2ncnn12
C#CCNc1c(Cc2ccccc2)c(C)nc2ncnn12
Cc1nc2nc(SCC(=O)O)nn2c(N(C)C)c1Cc1ccccc1
COc1cccc(F)c1-c1nc(C(=O)Nc2cc(F)ccc2N2CCC(NS(N)(=O)=O)CC2)cn2ccnc12
COc1ccc2c(ccnc2c1)-c1ccc(CNS(N)(=O)=O)cc1