2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(2-methylphenyl)propanamide

Systemtic Name: 2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(2-methylphenyl)propanamide Openeye Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(o-tolyl)propanamide CAS Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-(2-methylphenyl)propanamide IUPAC Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2-methylphenyl)propanamide Traditional Name: 2-[(5-cyano-6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]-N-(o-tolyl)propionamide Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N=C(N1)SC(C)C(=O)NC2=CC=CC=C2C)C#N

Isomeric SMILES

CCC1=C(C(=O)N=C(N1)SC(C)C(=O)NC2=CC=CC=C2C)C#N

InChI

InChI=1S/C17H18N4O2S/c1-4-13-12(9-18)16(23)21-17(20-13)24-11(3)15(22)19-14-8-6-5-7-10(14)2/h5-8,11H,4H2,1-3H3,(H,19,22)(H,20,21,23)