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

Systemtic Name: N-(3,5-dimethylphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1-benzylbenzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperazine-1-carboxamide CAS Name: N-(3,5-dimethylphenyl)-4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinecarboxamide IUPAC Name: 4-(1-benzylbenzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperazine-1-carboxamide Traditional Name: 4-(1-benzylbenzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperazine-1-carboxamide Formula: C27H29N5O MolecularWeight: 439.55206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5)C

InChI

InChI=1S/C27H29N5O/c1-20-16-21(2)18-23(17-20)28-27(33)31-14-12-30(13-15-31)26-29-24-10-6-7-11-25(24)32(26)19-22-8-4-3-5-9-22/h3-11,16-18H,12-15,19H2,1-2H3,(H,28,33)