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

Systemtic Name: 4-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]-1-(2-ethoxyphenyl)pyrrolidin-2-one Openeye Name: 4-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]-1-(2-ethoxyphenyl)pyrrolidin-2-one CAS Name: 4-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]-1-(2-ethoxyphenyl)-2-pyrrolidinone IUPAC Name: 4-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]-1-(2-ethoxyphenyl)pyrrolidin-2-one Traditional Name: 4-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]-1-o-phenetyl-2-pyrrolidone Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCC(=O)N5CCCCCC5

Isomeric SMILES

CCOC1=CC=CC=C1N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCC(=O)N5CCCCCC5

InChI

InChI=1S/C28H34N4O3/c1-2-35-25-14-8-7-13-24(25)32-20-21(19-27(32)34)28-29-22-11-5-6-12-23(22)31(28)18-15-26(33)30-16-9-3-4-10-17-30/h5-8,11-14,21H,2-4,9-10,15-20H2,1H3