5-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]-2-(2-methylphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]-2-(2-methylphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 2-isopropyl-5-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]-2-(o-tolyl)pentanenitrile CAS Name: 5-[4-(1-methyl-2-benzimidazolyl)-1-piperazinyl]-2-(2-methylphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]-2-(2-methylphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 2-isopropyl-5-[4-(1-methylbenzimidazol-2-yl)piperazino]-2-(o-tolyl)valeronitrile Formula: C27H35N5 MolecularWeight: 429.6003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCCN2CCN(CC2)C3=NC4=CC=CC=C4N3C)(C#N)C(C)C

Isomeric SMILES

CC1=CC=CC=C1C(CCCN2CCN(CC2)C3=NC4=CC=CC=C4N3C)(C#N)C(C)C

InChI

InChI=1S/C27H35N5/c1-21(2)27(20-28,23-11-6-5-10-22(23)3)14-9-15-31-16-18-32(19-17-31)26-29-24-12-7-8-13-25(24)30(26)4/h5-8,10-13,21H,9,14-19H2,1-4H3