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

Systemtic Name: N-(2-cyanoethyl)-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-phenyl-acetamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC(=O)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC(=O)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C16H16N4O2S/c1-12-10-14(21)19-16(18-12)23-11-15(22)20(9-5-8-17)13-6-3-2-4-7-13/h2-4,6-7,10H,5,9,11H2,1H3,(H,18,19,21)