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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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