N-(2-cyanoethyl)-N-(4-methylphenyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(p-tolyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N-(p-tolyl)acetamide Formula: C19H22N4O2S MolecularWeight: 370.46858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)N(CCC#N)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N(CCC#N)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H22N4O2S/c1-3-5-15-12-17(24)22-19(21-15)26-13-18(25)23(11-4-10-20)16-8-6-14(2)7-9-16/h6-9,12H,3-5,11,13H2,1-2H3,(H,21,22,24)