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

Systemtic Name: 4-[(Z)-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]benzenecarbonitrile Openeye Name: 4-[(Z)-(6-methyl-5-oxo-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]benzonitrile CAS Name: 4-[(Z)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]benzonitrile IUPAC Name: 4-[(Z)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]benzonitrile Traditional Name: 4-[(Z)-(5-keto-6-methyl-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]benzonitrile Formula: C12H9N5OS MolecularWeight: 271.29776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)N=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=NNC(=S)N(C1=O)/N=C\C2=CC=C(C=C2)C#N

InChI

InChI=1S/C12H9N5OS/c1-8-11(18)17(12(19)16-15-8)14-7-10-4-2-9(6-13)3-5-10/h2-5,7H,1H3,(H,16,19)/b14-7-