N-(3,5-dimethylphenyl)-1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(3,5-dimethylphenyl)-1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]isonipecotamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=CC=C5)C

InChI

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