2-[(5-cyano-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(5-cyano-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(5-cyano-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(5-cyano-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(5-cyano-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(5-cyano-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)NCCC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)NCCC2=CC=CC=C2)C#N

InChI

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