1-[2-(2,2-dimethyl-3-oxidanylidene-piperazin-1-yl)-2-oxidanylidene-ethyl]-6-(4-methylphenyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[2-(2,2-dimethyl-3-oxidanylidene-piperazin-1-yl)-2-oxidanylidene-ethyl]-6-(4-methylphenyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[2-(2,2-dimethyl-3-oxo-piperazin-1-yl)-2-oxo-ethyl]-2-oxo-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 1-[2-(2,2-dimethyl-3-oxo-1-piperazinyl)-2-oxoethyl]-6-(4-methylphenyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]-6-(4-methylphenyl)-2-oxopyridine-3-carbonitrile Traditional Name: 2-keto-1-[2-keto-2-(3-keto-2,2-dimethyl-piperazino)ethyl]-6-(p-tolyl)nicotinonitrile Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C(=O)N2CC(=O)N3CCNC(=O)C3(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C(=O)N2CC(=O)N3CCNC(=O)C3(C)C)C#N

InChI

InChI=1S/C21H22N4O3/c1-14-4-6-15(7-5-14)17-9-8-16(12-22)19(27)24(17)13-18(26)25-11-10-23-20(28)21(25,2)3/h4-9H,10-11,13H2,1-3H3,(H,23,28)