N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide Openeye Name: N-[2-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide CAS Name: N-[2-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]ethyl]-2,4-dimethylbenzamide IUPAC Name: N-[2-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]ethyl]-2,4-dimethylbenzamide Traditional Name: N-[2-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)C

InChI

InChI=1S/C27H34N4O2/c1-20-11-12-22(21(2)19-20)27(33)28-15-13-25-29-23-9-5-6-10-24(23)31(25)18-14-26(32)30-16-7-3-4-8-17-30/h5-6,9-12,19H,3-4,7-8,13-18H2,1-2H3,(H,28,33)