4-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]-1-(2-methylphenyl)pyrrolidin-2-one

Systemtic Name: 4-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]-1-(2-methylphenyl)pyrrolidin-2-one Openeye Name: 4-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]-1-(o-tolyl)pyrrolidin-2-one CAS Name: 4-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]-1-(2-methylphenyl)-2-pyrrolidinone IUPAC Name: 4-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]-1-(2-methylphenyl)pyrrolidin-2-one Traditional Name: 4-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]-1-(o-tolyl)-2-pyrrolidone Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCC(=O)N5CCCCCC5

Isomeric SMILES

CC1=CC=CC=C1N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCC(=O)N5CCCCCC5

InChI

InChI=1S/C27H32N4O2/c1-20-10-4-6-12-23(20)31-19-21(18-26(31)33)27-28-22-11-5-7-13-24(22)30(27)17-14-25(32)29-15-8-2-3-9-16-29/h4-7,10-13,21H,2-3,8-9,14-19H2,1H3