5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide

C164H136F8N24O22S5 — CID 158659614

IUPAC5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cc(F)c4nc(C)n(-c5ccc(F)c(C(N)=O)c5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cc(F)c4ncn(-c5ccc(F)c(C(N)=O)c5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4cnn(-c5ccc(C#N)cc5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4cnn(-c5ccc(C(F)(F)F)cc5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4nnc(-c5ccc(F)cc5)n4c3)cc12
InChIInChI=1S/C34H29F2N5O5S.C33H27F3N4O4S.C33H27F2N5O5S.C33H27N5O4S.C31H26FN5O4S/c1-17-6-8-19(9-7-17)32-30(34(43)38-3)24-15-22(27(16-29(24)46-32)40(4)47(5,44)45)20-12-26(36)31-28(13-20)41(18(2)39-31)21-10-11-25(35)23(14-21)33(37)42;1-19-5-7-20(8-6-19)31-30(32(41)37-2)26-16-25(28(17-29(26)44-31)39(3)45(4,42)43)21-9-10-22-18-38-40(27(22)15-21)24-13-11-23(12-14-24)33(34,35)36;1-17-5-7-18(8-6-17)31-29(33(42)37-2)23-14-21(26(15-28(23)45-31)39(3)46(4,43)44)19-11-25(35)30-27(12-19)40(16-38-30)20-9-10-24(34)22(13-20)32(36)41;1-20-5-9-22(10-6-20)32-31(33(39)35-2)27-16-26(29(17-30(27)42-32)37(3)43(4,40)41)23-11-12-24-19-36-38(28(24)15-23)25-13-7-21(18-34)8-14-25;1-18-5-7-19(8-6-18)29-28(31(38)33-2)24-15-23(25(16-26(24)41-29)36(3)42(4,39)40)21-11-14-27-34-35-30(37(27)17-21)20-9-12-22(32)13-10-20/h6-16H,1-5H3,(H2,37,42)(H,38,43);5-18H,1-4H3,(H,37,41);5-16H,1-4H3,(H2,36,41)(H,37,42);5-17,19H,1-4H3,(H,35,39);5-17H,1-4H3,(H,33,38)
InChIKeyICOYDLSAANYEBA-UHFFFAOYSA-N
MW3107.36 g/mol
LogP30.31
Rot. Bonds32

About 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide

5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide (PubChem CID 158659614) has the molecular formula C164H136F8N24O22S5 and a molecular weight of 3107.36 g/mol. Its IUPAC name is 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide.

Molecular Properties

Compound Name5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide
PubChem CID158659614
Molecular FormulaC164H136F8N24O22S5
Molecular Weight3107.36 g/mol
Exact Mass3104.87
IUPAC Name5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cc(F)c4nc(C)n(-c5ccc(F)c(C(N)=O)c5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cc(F)c4ncn(-c5ccc(F)c(C(N)=O)c5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4cnn(-c5ccc(C#N)cc5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4cnn(-c5ccc(C(F)(F)F)cc5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4nnc(-c5ccc(F)cc5)n4c3)cc12
InChIInChI=1S/C34H29F2N5O5S.C33H27F3N4O4S.C33H27F2N5O5S.C33H27N5O4S.C31H26FN5O4S/c1-17-6-8-19(9-7-17)32-30(34(43)38-3)24-15-22(27(16-29(24)46-32)40(4)47(5,44)45)20-12-26(36)31-28(13-20)41(18(2)39-31)21-10-11-25(35)23(14-21)33(37)42;1-19-5-7-20(8-6-19)31-30(32(41)37-2)26-16-25(28(17-29(26)44-31)39(3)45(4,42)43)21-9-10-22-18-38-40(27(22)15-21)24-13-11-23(12-14-24)33(34,35)36;1-17-5-7-18(8-6-17)31-29(33(42)37-2)23-14-21(26(15-28(23)45-31)39(3)46(4,43)44)19-11-25(35)30-27(12-19)40(16-38-30)20-9-10-24(34)22(13-20)32(36)41;1-20-5-9-22(10-6-20)32-31(33(39)35-2)27-16-26(29(17-30(27)42-32)37(3)43(4,40)41)23-11-12-24-19-36-38(28(24)15-23)25-13-7-21(18-34)8-14-25;1-18-5-7-19(8-6-18)29-28(31(38)33-2)24-15-23(25(16-26(24)41-29)36(3)42(4,39)40)21-11-14-27-34-35-30(37(27)17-21)20-9-12-22(32)13-10-20/h6-16H,1-5H3,(H2,37,42)(H,38,43);5-18H,1-4H3,(H,37,41);5-16H,1-4H3,(H2,36,41)(H,37,42);5-17,19H,1-4H3,(H,35,39);5-17H,1-4H3,(H,33,38)
InChIKeyICOYDLSAANYEBA-UHFFFAOYSA-N
XLogP30.31
TPSA609.54 Ų
H-Bond Donors7
H-Bond Acceptors34
Rotatable Bonds32
Heavy Atoms223
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003107.36
LogP ≤ 530.31
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1034

Analyze 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide with MolForge

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Related Compounds

2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-5-[3-(1-pyridin-3-ylbenzimidazol-2-yl)phenyl]-1-benzofuran-3-carboxamide
CID 68239714
2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-5-[3-([1,2,4]triazolo[1,5-a]pyrazin-2-yl)phenyl]-1-benzofuran-3-carboxamide
CID 71142002
2-(4-fluorophenyl)-5-(3-(4-fluorophenyl)imidazo[1,2-a]pyrazin-6-yl)-N-methyl-6-(N-methylmethylsulfonamido)benzofuran-3-carboxamide
CID 71295324
2-(4-fluorophenyl)-N-methyl-6-(N-methylmethylsulfonamido)-5-(3-(4-(trifluoromethyl)phenyl)imidazo[1,2-b]pyridazin-6-yl)benzofuran-3-carboxamide
CID 71295603
2-(4-fluorophenyl)-5-(3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-N-methyl-6-(N-methylmethylsulfonamido)benzofuran-3-carboxamide
CID 71295643
5-(8-(1H-indol-2-yl)-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-fluorophenyl)-N-methyl-6-(N-methylmethylsulfonamido)benzofuran-3-carboxamide
CID 71295655
2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-5-[9-[4-(trifluoromethoxy)phenyl]purin-2-yl]-1-benzofuran-3-carboxamide
CID 71509980
2-(4-fluorophenyl)-5-[9-(4-fluorophenyl)purin-2-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-1-benzofuran-3-carboxamide
CID 71510121
2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-5-[9-[4-(trifluoromethyl)phenyl]purin-2-yl]-1-benzofuran-3-carboxamide
CID 71510122
5-[9-(4-cyanophenyl)purin-2-yl]-2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-1-benzofuran-3-carboxamide
CID 71510123
2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-5-[3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-6-yl]-1-benzofuran-3-carboxamide
CID 71510188
2-(4-fluorophenyl)-5-[3-(4-fluorophenyl)imidazo[1,2-b]pyridazin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-1-benzofuran-3-carboxamide
CID 71510316

Frequently Asked Questions

What is the IUPAC name of 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide?
The IUPAC name of 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide (CID 158659614) is 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide.
What is the SMILES notation for 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide?
The canonical SMILES for 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide is CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cc(F)c4nc(C)n(-c5ccc(F)c(C(N)=O)c5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cc(F)c4ncn(-c5ccc(F)c(C(N)=O)c5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4cnn(-c5ccc(C#N)cc5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4cnn(-c5ccc(C(F)(F)F)cc5)c4c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4nnc(-c5ccc(F)cc5)n4c3)cc12.
What is the InChIKey of 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide?
The InChIKey is ICOYDLSAANYEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H29F2N5O5S.C33H27F3N4O4S.C33H27F2N5O5S.C33H27N5O4S.C31H26FN5O4S/c1-17-6-8-19(9-7-17)32-30(34(43)38-3)24-15-22(27(16-29(24)46-32)40(4)47(5,44)45)20-12-26(36)31-28(13-20)41(18(2)39-31)21-10-11-25(35)23(14-21)33(37)42;1-19-5-7-20(8-6-19)31-30(32(41)37-2)26-16-25(28(17-29(26)44-31)39(3)45(4,42)43)21-9-10-22-18-38-40(27(22)15-21)24-13-11-23(12-14-24)33(34,35)36;1-17-5-7-18(8-6-17)31-29(33(42)37-2)23-14-21(26(15-28(23)45-31)39(3)46(4,43)44)19-11-25(35)30-27(12-19)40(16-38-30)20-9-10-24(34)22(13-20)32(36)41;1-20-5-9-22(10-6-20)32-31(33(39)35-2)27-16-26(29(17-30(27)42-32)37(3)43(4,40)41)23-11-12-24-19-36-38(28(24)15-23)25-13-7-21(18-34)8-14-25;1-18-5-7-19(8-6-18)29-28(31(38)33-2)24-15-23(25(16-26(24)41-29)36(3)42(4,39)40)21-11-14-27-34-35-30(37(27)17-21)20-9-12-22(32)13-10-20/h6-16H,1-5H3,(H2,37,42)(H,38,43);5-18H,1-4H3,(H,37,41);5-16H,1-4H3,(H2,36,41)(H,37,42);5-17,19H,1-4H3,(H,35,39);5-17H,1-4H3,(H,33,38).
What are the key properties of 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide?
5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide has a molecular weight of 3107.36 g/mol, XLogP of 30.31, 32 rotatable bonds, 7 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluorobenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(3-carbamoyl-4-fluorophenyl)-7-fluoro-2-methylbenzimidazol-5-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-cyanophenyl)indazol-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]indazol-6-yl]-1-benzofuran-3-carboxamide is sourced from PubChem (CID 158659614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).