6-(ethylsulfonylamino)-3-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenyl-benzimidazole-4-carboxamide

Systemtic Name: 6-(ethylsulfonylamino)-3-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenyl-benzimidazole-4-carboxamide Openeye Name: 6-(ethylsulfonylamino)-3-methyl-N-[(3S)-2-oxoazepan-3-yl]-2-phenyl-benzimidazole-4-carboxamide CAS Name: 6-(ethylsulfonylamino)-3-methyl-N-[(3S)-2-oxo-3-azepanyl]-2-phenyl-4-benzimidazolecarboxamide IUPAC Name: 6-(ethylsulfonylamino)-3-methyl-N-[(3S)-2-oxoazepan-3-yl]-2-phenylbenzimidazole-4-carboxamide Traditional Name: 6-(esylamino)-N-[(3S)-2-ketoazepan-3-yl]-3-methyl-2-phenyl-benzimidazole-4-carboxamide Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC2=C(C(=C1)C(=O)NC3CCCCNC3=O)N(C(=N2)C4=CC=CC=C4)C

Isomeric SMILES

CCS(=O)(=O)NC1=CC2=C(C(=C1)C(=O)N[C@H]3CCCCNC3=O)N(C(=N2)C4=CC=CC=C4)C

InChI

InChI=1S/C23H27N5O4S/c1-3-33(31,32)27-16-13-17(22(29)26-18-11-7-8-12-24-23(18)30)20-19(14-16)25-21(28(20)2)15-9-5-4-6-10-15/h4-6,9-10,13-14,18,27H,3,7-8,11-12H2,1-2H3,(H,24,30)(H,26,29)/t18-/m0/s1