3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]-N-naphthalen-1-yl-piperazine-1-carboxamide

Systemtic Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]-N-naphthalen-1-yl-piperazine-1-carboxamide Openeye Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]-N-(1-naphthyl)piperazine-1-carboxamide CAS Name: 3-[[4-(1-benzimidazolyl)-2-pyrimidinyl]-methylamino]-N-(1-naphthalenyl)-1-piperazinecarboxamide IUPAC Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methylamino]-N-naphthalen-1-ylpiperazine-1-carboxamide Traditional Name: 3-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]-N-(1-naphthyl)piperazine-1-carboxamide Formula: C27H26N8O MolecularWeight: 478.54834

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CN(CCN1)C(=O)NC2=CC=CC3=CC=CC=C32)C4=NC=CC(=N4)N5C=NC6=CC=CC=C65

Isomeric SMILES

CN(C1CN(CCN1)C(=O)NC2=CC=CC3=CC=CC=C32)C4=NC=CC(=N4)N5C=NC6=CC=CC=C65

InChI

InChI=1S/C27H26N8O/c1-33(26-29-14-13-24(32-26)35-18-30-22-10-4-5-12-23(22)35)25-17-34(16-15-28-25)27(36)31-21-11-6-8-19-7-2-3-9-20(19)21/h2-14,18,25,28H,15-17H2,1H3,(H,31,36)