1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide

C270H304F30N30O42S10 — CID 160876235

IUPAC1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide
SMILESCCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc([C@@H](C)c2ccc(C(F)(F)F)cc2)n3C2CC2)cc1.CCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc([C@H](C)c2ccc(C(F)(F)F)cc2)n3C2CC2)cc1.CCn1c(C[C@@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21
InChIInChI=1S/2C29H28F3N3O3S.4C27H32F3N3O5S.4C26H30F3N3O4S/c2*1-3-39(37,38)24-13-4-19(5-14-24)17-33-28(36)21-8-15-26-25(16-21)34-27(35(26)23-11-12-23)18(2)20-6-9-22(10-7-20)29(30,31)32;4*1-3-33-23-11-8-19(14-21(23)31-25(33)13-17-5-12-24(38-16-17)27(28,29)30)26(35)32-22(15-34)18-6-9-20(10-7-18)39(36,37)4-2;4*1-3-32-22-11-8-19(25(33)30-15-17-5-9-20(10-6-17)37(34,35)4-2)14-21(22)31-24(32)13-18-7-12-23(36-16-18)26(27,28)29/h2*4-10,13-16,18,23H,3,11-12,17H2,1-2H3,(H,33,36);4*6-11,14,17,22,24,34H,3-5,12-13,15-16H2,1-2H3,(H,32,35);4*5-6,8-11,14,18,23H,3-4,7,12-13,15-16H2,1-2H3,(H,30,33)/t2*18-;17-,22+,24+;17-,22+,24-;17-,22-,24+;17-,22-,24-;2*18-,23+;2*18-,23-/m1011001010/s1
InChIKeySMKUNWPVWRREGM-WWJSCTCLSA-N
MW5532.18 g/mol
LogP48.10
Rot. Bonds84

About 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide

1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide (PubChem CID 160876235) has the molecular formula C270H304F30N30O42S10 and a molecular weight of 5532.18 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide
PubChem CID160876235
Molecular FormulaC270H304F30N30O42S10
Molecular Weight5532.18 g/mol
Exact Mass5527.93
IUPAC Name1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide
SMILESCCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc([C@@H](C)c2ccc(C(F)(F)F)cc2)n3C2CC2)cc1.CCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc([C@H](C)c2ccc(C(F)(F)F)cc2)n3C2CC2)cc1.CCn1c(C[C@@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21
InChIInChI=1S/2C29H28F3N3O3S.4C27H32F3N3O5S.4C26H30F3N3O4S/c2*1-3-39(37,38)24-13-4-19(5-14-24)17-33-28(36)21-8-15-26-25(16-21)34-27(35(26)23-11-12-23)18(2)20-6-9-22(10-7-20)29(30,31)32;4*1-3-33-23-11-8-19(14-21(23)31-25(33)13-17-5-12-24(38-16-17)27(28,29)30)26(35)32-22(15-34)18-6-9-20(10-7-18)39(36,37)4-2;4*1-3-32-22-11-8-19(25(33)30-15-17-5-9-20(10-6-17)37(34,35)4-2)14-21(22)31-24(32)13-18-7-12-23(36-16-18)26(27,28)29/h2*4-10,13-16,18,23H,3,11-12,17H2,1-2H3,(H,33,36);4*6-11,14,17,22,24,34H,3-5,12-13,15-16H2,1-2H3,(H,32,35);4*5-6,8-11,14,18,23H,3-4,7,12-13,15-16H2,1-2H3,(H,30,33)/t2*18-;17-,22+,24+;17-,22+,24-;17-,22-,24+;17-,22-,24-;2*18-,23+;2*18-,23-/m1011001010/s1
InChIKeySMKUNWPVWRREGM-WWJSCTCLSA-N
XLogP48.10
TPSA965.36 Ų
H-Bond Donors14
H-Bond Acceptors62
Rotatable Bonds84
Heavy Atoms382
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005532.18
LogP ≤ 548.10
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1062

Analyze 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide?
The IUPAC name of 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide (CID 160876235) is 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide is CCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc([C@@H](C)c2ccc(C(F)(F)F)cc2)n3C2CC2)cc1.CCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc([C@H](C)c2ccc(C(F)(F)F)cc2)n3C2CC2)cc1.CCn1c(C[C@@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)NCc3ccc(S(=O)(=O)CC)cc3)ccc21.CCn1c(C[C@H]2CC[C@H](C(F)(F)F)OC2)nc2cc(C(=O)N[C@@H](CO)c3ccc(S(=O)(=O)CC)cc3)ccc21.
What is the InChIKey of 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide?
The InChIKey is SMKUNWPVWRREGM-WWJSCTCLSA-N. The full InChI is InChI=1S/2C29H28F3N3O3S.4C27H32F3N3O5S.4C26H30F3N3O4S/c2*1-3-39(37,38)24-13-4-19(5-14-24)17-33-28(36)21-8-15-26-25(16-21)34-27(35(26)23-11-12-23)18(2)20-6-9-22(10-7-20)29(30,31)32;4*1-3-33-23-11-8-19(14-21(23)31-25(33)13-17-5-12-24(38-16-17)27(28,29)30)26(35)32-22(15-34)18-6-9-20(10-7-18)39(36,37)4-2;4*1-3-32-22-11-8-19(25(33)30-15-17-5-9-20(10-6-17)37(34,35)4-2)14-21(22)31-24(32)13-18-7-12-23(36-16-18)26(27,28)29/h2*4-10,13-16,18,23H,3,11-12,17H2,1-2H3,(H,33,36);4*6-11,14,17,22,24,34H,3-5,12-13,15-16H2,1-2H3,(H,32,35);4*5-6,8-11,14,18,23H,3-4,7,12-13,15-16H2,1-2H3,(H,30,33)/t2*18-;17-,22+,24+;17-,22+,24-;17-,22-,24+;17-,22-,24-;2*18-,23+;2*18-,23-/m1011001010/s1.
What are the key properties of 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide?
1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide has a molecular weight of 5532.18 g/mol, XLogP of 48.10, 84 rotatable bonds, 14 hydrogen bond donors, and 62 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-cyclopropyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(4-ethylsulfonylphenyl)methyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide is sourced from PubChem (CID 160876235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).