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

Systemtic Name: 2-[(5-cyano-6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-N-(4-phenylbutan-2-yl)ethanamide Openeye Name: 2-[(5-cyano-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]-N-(1-methyl-3-phenyl-propyl)acetamide CAS Name: 2-[(5-cyano-6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]-N-(4-phenylbutan-2-yl)acetamide IUPAC Name: 2-[(5-cyano-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide Traditional Name: 2-[(5-cyano-2-keto-6-methyl-1H-pyrimidin-4-yl)thio]-N-(1-methyl-3-phenyl-propyl)acetamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)NC(C)CCC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)NC(C)CCC2=CC=CC=C2)C#N

InChI

InChI=1S/C18H20N4O2S/c1-12(8-9-14-6-4-3-5-7-14)20-16(23)11-25-17-15(10-19)13(2)21-18(24)22-17/h3-7,12H,8-9,11H2,1-2H3,(H,20,23)(H,21,22,24)