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

Systemtic Name: N-[3-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]propyl]-2,4-dimethyl-benzamide Openeye Name: N-[3-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]propyl]-2,4-dimethyl-benzamide CAS Name: N-[3-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]propyl]-2,4-dimethylbenzamide IUPAC Name: N-[3-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]propyl]-2,4-dimethylbenzamide Traditional Name: N-[3-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]propyl]-2,4-dimethyl-benzamide Formula: C28H36N4O2 MolecularWeight: 460.61104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)C

InChI

InChI=1S/C28H36N4O2/c1-21-13-14-23(22(2)20-21)28(34)29-16-9-12-26-30-24-10-5-6-11-25(24)32(26)19-15-27(33)31-17-7-3-4-8-18-31/h5-6,10-11,13-14,20H,3-4,7-9,12,15-19H2,1-2H3,(H,29,34)