6-methyl-3-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-methyl-3-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 6-methyl-3-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazin-5-olate CAS Name: 6-methyl-3-[[2-[2-(methylthio)anilino]-2-oxoethyl]thio]-1,2,4-triazin-5-olate IUPAC Name: 6-methyl-3-[2-(2-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-keto-2-[2-(methylthio)anilino]ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C13H13N4O2S2- MolecularWeight: 321.39792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC(=O)NC2=CC=CC=C2SC)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC(=O)NC2=CC=CC=C2SC)[O-]

InChI

InChI=1S/C13H14N4O2S2/c1-8-12(19)15-13(17-16-8)21-7-11(18)14-9-5-3-4-6-10(9)20-2/h3-6H,7H2,1-2H3,(H,14,18)(H,15,17,19)/p-1