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

Systemtic Name: 4-[(Z)-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]benzoate Openeye Name: 4-[(Z)-(6-methyl-5-oxo-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]benzoate CAS Name: 4-[(Z)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]benzoate IUPAC Name: 4-[(Z)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]benzoate Traditional Name: 4-[(Z)-(5-keto-6-methyl-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]benzoate Formula: C12H9N4O3S- MolecularWeight: 289.28986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)N=CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N(C1=O)/N=C\C2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C12H10N4O3S/c1-7-10(17)16(12(20)15-14-7)13-6-8-2-4-9(5-3-8)11(18)19/h2-6H,1H3,(H,15,20)(H,18,19)/p-1/b13-6-