methyl 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoate

Systemtic Name: methyl 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoate Openeye Name: methyl 3-[(3-thioxo-2H-1,2,4-triazin-5-yl)amino]benzoate CAS Name: 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoate Traditional Name: 3-[(3-thioxo-2H-1,2,4-triazin-5-yl)amino]benzoic acid methyl ester Formula: C11H10N4O2S MolecularWeight: 262.2877

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NC(=S)NN=C2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NC(=S)NN=C2

InChI

InChI=1S/C11H10N4O2S/c1-17-10(16)7-3-2-4-8(5-7)13-9-6-12-15-11(18)14-9/h2-6H,1H3,(H2,13,14,15,18)