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

Systemtic Name: 6-[(2-methoxyphenyl)methylsulfanyl]-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: 6-[(2-methoxyphenyl)methylsulfanyl]-4,4-dimethyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: 6-[(2-methoxyphenyl)methylthio]-4,4-dimethyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: 6-[(2-methoxyphenyl)methylsulfanyl]-4,4-dimethyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: 2-keto-4,4-dimethyl-6-(o-anisylthio)-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SCC2=CC=CC=C2OC)C#N)C

Isomeric SMILES

CC1(C(C(=O)NC(=C1C#N)SCC2=CC=CC=C2OC)C#N)C

InChI

InChI=1S/C17H17N3O2S/c1-17(2)12(8-18)15(21)20-16(13(17)9-19)23-10-11-6-4-5-7-14(11)22-3/h4-7,12H,10H2,1-3H3,(H,20,21)