1-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]-N-(3-propylsulfanylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]-N-(3-propylsulfanylpropyl)piperidine-4-carboxamide Openeye Name: 1-[1-(o-tolylmethyl)benzimidazol-2-yl]-N-(3-propylsulfanylpropyl)piperidine-4-carboxamide CAS Name: 1-[1-[(2-methylphenyl)methyl]-2-benzimidazolyl]-N-[3-(propylthio)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]-N-(3-propylsulfanylpropyl)piperidine-4-carboxamide Traditional Name: 1-[1-(2-methylbenzyl)benzimidazol-2-yl]-N-[3-(propylthio)propyl]isonipecotamide Formula: C27H36N4OS MolecularWeight: 464.66594

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCNC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=CC=C4C

Isomeric SMILES

CCCSCCCNC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=CC=C4C

InChI

InChI=1S/C27H36N4OS/c1-3-18-33-19-8-15-28-26(32)22-13-16-30(17-14-22)27-29-24-11-6-7-12-25(24)31(27)20-23-10-5-4-9-21(23)2/h4-7,9-12,22H,3,8,13-20H2,1-2H3,(H,28,32)