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

Systemtic Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(4-chlorophenyl)piperidine-1-carboxamide Openeye Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(4-chlorophenyl)piperidine-1-carboxamide CAS Name: 3-[[4-(1-benzimidazolyl)-2-pyrimidinyl]-ethylamino]-N-(4-chlorophenyl)-1-piperidinecarboxamide IUPAC Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethylamino]-N-(4-chlorophenyl)piperidine-1-carboxamide Traditional Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-ethyl-amino]-N-(4-chlorophenyl)piperidine-1-carboxamide Formula: C25H26ClN7O MolecularWeight: 475.97324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26ClN7O/c1-2-32(20-6-5-15-31(16-20)25(34)29-19-11-9-18(26)10-12-19)24-27-14-13-23(30-24)33-17-28-21-7-3-4-8-22(21)33/h3-4,7-14,17,20H,2,5-6,15-16H2,1H3,(H,29,34)