2-[(5-cyano-6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-N-(3-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-[(5-cyano-6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-N-(3-propan-2-ylphenyl)ethanamide Openeye Name: 2-[(5-cyano-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]-N-(3-isopropylphenyl)acetamide CAS Name: 2-[(5-cyano-6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]-N-(3-propan-2-ylphenyl)acetamide IUPAC Name: 2-[(5-cyano-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]-N-(3-propan-2-ylphenyl)acetamide Traditional Name: 2-[(5-cyano-2-keto-6-methyl-1H-pyrimidin-4-yl)thio]-N-m-cumenyl-acetamide Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)NC2=CC=CC(=C2)C(C)C)C#N

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)NC2=CC=CC(=C2)C(C)C)C#N

InChI

InChI=1S/C17H18N4O2S/c1-10(2)12-5-4-6-13(7-12)20-15(22)9-24-16-14(8-18)11(3)19-17(23)21-16/h4-7,10H,9H2,1-3H3,(H,20,22)(H,19,21,23)