3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(4-methylphenyl)piperidine-1-carboxamide

Systemtic Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(4-methylphenyl)piperidine-1-carboxamide Openeye Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(p-tolyl)piperidine-1-carboxamide CAS Name: 3-[[4-(1-benzimidazolyl)-2-pyrimidinyl]-ethylamino]-N-(4-methylphenyl)-1-piperidinecarboxamide IUPAC Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethylamino]-N-(4-methylphenyl)piperidine-1-carboxamide Traditional Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(p-tolyl)piperidine-1-carboxamide Formula: C26H29N7O MolecularWeight: 455.55476

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCN(C1)C(=O)NC2=CC=C(C=C2)C)C3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

CCN(C1CCCN(C1)C(=O)NC2=CC=C(C=C2)C)C3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C26H29N7O/c1-3-32(21-7-6-16-31(17-21)26(34)29-20-12-10-19(2)11-13-20)25-27-15-14-24(30-25)33-18-28-22-8-4-5-9-23(22)33/h4-5,8-15,18,21H,3,6-7,16-17H2,1-2H3,(H,29,34)