N-[4-(benzimidazol-1-yl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(benzimidazol-1-yl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(benzimidazol-1-yl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(1-benzimidazolyl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(benzimidazol-1-yl)phenyl]-1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(benzimidazol-1-yl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C=NC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C=NC5=CC=CC=C54)C

InChI

InChI=1S/C27H28N4O3S/c1-19-7-12-26(20(2)17-19)35(33,34)30-15-13-21(14-16-30)27(32)29-22-8-10-23(11-9-22)31-18-28-24-5-3-4-6-25(24)31/h3-12,17-18,21H,13-16H2,1-2H3,(H,29,32)