N-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]methyl]-2-methyl-prop-2-enamide

Systemtic Name: N-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]methyl]-2-methyl-prop-2-enamide Openeye Name: N-[[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]methyl]-2-methyl-prop-2-enamide CAS Name: N-[[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]methyl]-2-methyl-2-propenamide IUPAC Name: N-[[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]methyl]-2-methylprop-2-enamide Traditional Name: N-[[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]methyl]-2-methyl-acrylamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NCC1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3

Isomeric SMILES

CC(=C)C(=O)NCC1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3

InChI

InChI=1S/C20H26N4O2/c1-15(2)20(26)21-13-18-22-16-9-5-6-10-17(16)24(18)14-19(25)23-11-7-3-4-8-12-23/h5-6,9-10H,1,3-4,7-8,11-14H2,2H3,(H,21,26)