(3S)-6-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: (3S)-6-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: (3S)-6-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4,4-dimethyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: (3S)-6-[(3-fluoro-4-methoxyphenyl)methylthio]-4,4-dimethyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (3S)-6-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4,4-dimethyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: (3S)-6-[(3-fluoro-4-methoxy-benzyl)thio]-2-keto-4,4-dimethyl-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SCC2=CC(=C(C=C2)OC)F)C#N)C

Isomeric SMILES

CC1([C@H](C(=O)NC(=C1C#N)SCC2=CC(=C(C=C2)OC)F)C#N)C

InChI

InChI=1S/C17H16FN3O2S/c1-17(2)11(7-19)15(22)21-16(12(17)8-20)24-9-10-4-5-14(23-3)13(18)6-10/h4-6,11H,9H2,1-3H3,(H,21,22)/t11-/m0/s1