N-[2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide

Systemtic Name: N-[2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide Openeye Name: N-[2-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide CAS Name: N-[2-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]ethyl]-4-methylbenzamide IUPAC Name: N-[2-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]-4-methylbenzamide Traditional Name: N-[2-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4

InChI

InChI=1S/C25H30N4O2/c1-19-10-12-20(13-11-19)25(31)26-15-14-23-27-21-8-4-5-9-22(21)29(23)18-24(30)28-16-6-2-3-7-17-28/h4-5,8-13H,2-3,6-7,14-18H2,1H3,(H,26,31)