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

Systemtic Name: 3-cyano-N-[2-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]phenyl]benzamide Openeye Name: 3-cyano-N-[2-[2-(1,4-diazepan-1-yl)-2-oxo-ethyl]phenyl]benzamide CAS Name: 3-cyano-N-[2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]phenyl]benzamide IUPAC Name: 3-cyano-N-[2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]phenyl]benzamide Traditional Name: 3-cyano-N-[2-[2-(1,4-diazepan-1-yl)-2-keto-ethyl]phenyl]benzamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)CC2=CC=CC=C2NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CNCCN(C1)C(=O)CC2=CC=CC=C2NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H22N4O2/c22-15-16-5-3-7-18(13-16)21(27)24-19-8-2-1-6-17(19)14-20(26)25-11-4-9-23-10-12-25/h1-3,5-8,13,23H,4,9-12,14H2,(H,24,27)