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

Systemtic Name: N-(3-ethanoylphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide Openeye Name: N-(3-acetylphenyl)-4-(1-benzylbenzimidazol-2-yl)piperazine-1-carboxamide CAS Name: N-(3-acetylphenyl)-4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinecarboxamide IUPAC Name: N-(3-acetylphenyl)-4-(1-benzylbenzimidazol-2-yl)piperazine-1-carboxamide Traditional Name: N-(3-acetylphenyl)-4-(1-benzylbenzimidazol-2-yl)piperazine-1-carboxamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27N5O2/c1-20(33)22-10-7-11-23(18-22)28-27(34)31-16-14-30(15-17-31)26-29-24-12-5-6-13-25(24)32(26)19-21-8-3-2-4-9-21/h2-13,18H,14-17,19H2,1H3,(H,28,34)