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

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-[[1-(phenylmethyl)benzimidazol-2-yl]methyl]piperazine-1-carboxamide Openeye Name: 4-[(1-benzylbenzimidazol-2-yl)methyl]-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-4-[[1-(phenylmethyl)-2-benzimidazolyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[(1-benzylbenzimidazol-2-yl)methyl]-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[(1-benzylbenzimidazol-2-yl)methyl]-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide Formula: C28H31N5O3 MolecularWeight: 485.57744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3CC5=CC=CC=C5)OC

InChI

InChI=1S/C28H31N5O3/c1-35-23-16-22(17-24(18-23)36-2)29-28(34)32-14-12-31(13-15-32)20-27-30-25-10-6-7-11-26(25)33(27)19-21-8-4-3-5-9-21/h3-11,16-18H,12-15,19-20H2,1-2H3,(H,29,34)