N-(2,3-dimethoxyphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(2,3-dimethoxyphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1-benzylbenzimidazol-2-yl)-N-(2,3-dimethoxyphenyl)piperazine-1-carboxamide CAS Name: N-(2,3-dimethoxyphenyl)-4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinecarboxamide IUPAC Name: 4-(1-benzylbenzimidazol-2-yl)-N-(2,3-dimethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(1-benzylbenzimidazol-2-yl)-N-(2,3-dimethoxyphenyl)piperazine-1-carboxamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1OC)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C27H29N5O3/c1-34-24-14-8-12-22(25(24)35-2)29-27(33)31-17-15-30(16-18-31)26-28-21-11-6-7-13-23(21)32(26)19-20-9-4-3-5-10-20/h3-14H,15-19H2,1-2H3,(H,29,33)