3-cyano-N-[4-[1-(1,4-diazepan-1-yl)-1-oxidanylidene-propan-2-yl]phenyl]benzamide

Systemtic Name: 3-cyano-N-[4-[1-(1,4-diazepan-1-yl)-1-oxidanylidene-propan-2-yl]phenyl]benzamide Openeye Name: 3-cyano-N-[4-[2-(1,4-diazepan-1-yl)-1-methyl-2-oxo-ethyl]phenyl]benzamide CAS Name: 3-cyano-N-[4-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]phenyl]benzamide IUPAC Name: 3-cyano-N-[4-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]phenyl]benzamide Traditional Name: 3-cyano-N-[4-[2-(1,4-diazepan-1-yl)-2-keto-1-methyl-ethyl]phenyl]benzamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC=CC(=C2)C#N)C(=O)N3CCCNCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC=CC(=C2)C#N)C(=O)N3CCCNCC3

InChI

InChI=1S/C22H24N4O2/c1-16(22(28)26-12-3-10-24-11-13-26)18-6-8-20(9-7-18)25-21(27)19-5-2-4-17(14-19)15-23/h2,4-9,14,16,24H,3,10-13H2,1H3,(H,25,27)