2-azanyl-6-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(4-methylphenyl)-2-oxoethyl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-keto-2-(p-tolyl)ethyl]thio]dinicotinonitrile Formula: C16H12N4OS MolecularWeight: 308.35768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=C(C=C(C(=N2)N)C#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=C(C=C(C(=N2)N)C#N)C#N

InChI

InChI=1S/C16H12N4OS/c1-10-2-4-11(5-3-10)14(21)9-22-16-13(8-18)6-12(7-17)15(19)20-16/h2-6H,9H2,1H3,(H2,19,20)