1-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-N-benzyl-piperidine-4-carboxamide CAS Name: 1-[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-N-benzylpiperidine-4-carboxamide Traditional Name: 1-[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]-N-benzyl-isonipecotamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C28H28N4O2S/c33-26(29-18-20-6-2-1-3-7-20)22-14-16-32(17-15-22)27(34)23-12-10-21(11-13-23)19-35-28-30-24-8-4-5-9-25(24)31-28/h1-13,22H,14-19H2,(H,29,33)(H,30,31)