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

Systemtic Name: N-[3-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]propyl]-2,4-dimethyl-benzamide Openeye Name: N-[3-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]propyl]-2,4-dimethyl-benzamide CAS Name: N-[3-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]propyl]-2,4-dimethylbenzamide IUPAC Name: N-[3-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]propyl]-2,4-dimethylbenzamide Traditional Name: N-[3-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]propyl]-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)NCCCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4)C

InChI

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