4-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]methyl]benzonitrile IUPAC Name: 4-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]methyl]benzonitrile Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=NNC(=NC1=O)SCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C12H10N4OS/c1-8-11(17)14-12(16-15-8)18-7-10-4-2-9(6-13)3-5-10/h2-5H,7H2,1H3,(H,14,16,17)