1-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-4,6-dimethyl-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-4,6-dimethyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-4,6-dimethyl-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-4,6-dimethyl-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-4,6-dimethyl-2-oxopyridine-3-carbonitrile Traditional Name: 1-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-2-keto-4,6-dimethyl-nicotinonitrile Formula: C21H24N4O MolecularWeight: 348.44146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1N=CC2=CC=C(C=C2)N3CCCCCC3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1/N=C\C2=CC=C(C=C2)N3CCCCCC3)C#N)C

InChI

InChI=1S/C21H24N4O/c1-16-13-17(2)25(21(26)20(16)14-22)23-15-18-7-9-19(10-8-18)24-11-5-3-4-6-12-24/h7-10,13,15H,3-6,11-12H2,1-2H3/b23-15-