N-(3-cyano-4-methyl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4-methyl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-4-methyl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-4-methylphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-cyano-4-methylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4-methyl-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)C#N

InChI

InChI=1S/C16H16N4OS/c1-10-4-5-14(7-13(10)8-17)20-15(21)9-22-16-18-11(2)6-12(3)19-16/h4-7H,9H2,1-3H3,(H,20,21)