N-(3,5-dimethoxyphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1-benzylbenzimidazol-2-yl)-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinecarboxamide IUPAC Name: 4-(1-benzylbenzimidazol-2-yl)-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(1-benzylbenzimidazol-2-yl)-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5)OC

InChI

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