(3R)-4,4-dimethyl-6-[(2-methylphenyl)methylsulfanyl]-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: (3R)-4,4-dimethyl-6-[(2-methylphenyl)methylsulfanyl]-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: (3R)-4,4-dimethyl-6-(o-tolylmethylsulfanyl)-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: (3R)-4,4-dimethyl-6-[(2-methylphenyl)methylthio]-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (3R)-4,4-dimethyl-6-[(2-methylphenyl)methylsulfanyl]-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: (3R)-2-keto-4,4-dimethyl-6-[(2-methylbenzyl)thio]-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C(C(C(=O)N2)C#N)(C)C)C#N

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C([C@@H](C(=O)N2)C#N)(C)C)C#N

InChI

InChI=1S/C17H17N3OS/c1-11-6-4-5-7-12(11)10-22-16-14(9-19)17(2,3)13(8-18)15(21)20-16/h4-7,13H,10H2,1-3H3,(H,20,21)/t13-/m1/s1