methyl 5-oxidanylidene-2-sulfanylidene-1,4-dihydropyrido[2,3-e][1,2,4]triazepine-3-carboxylate

Systemtic Name: methyl 5-oxidanylidene-2-sulfanylidene-1,4-dihydropyrido[2,3-e][1,2,4]triazepine-3-carboxylate Openeye Name: methyl 5-oxo-2-thioxo-1,4-dihydropyrido[2,3-e][1,2,4]triazepine-3-carboxylate CAS Name: 5-oxo-2-sulfanylidene-1,4-dihydropyrido[2,3-e][1,2,4]triazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-2-sulfanylidene-1,4-dihydropyrido[2,3-e][1,2,4]triazepine-3-carboxylate Traditional Name: 5-keto-2-thioxo-1,4-dihydropyrido[2,3-e][1,2,4]triazepine-3-carboxylic acid methyl ester Formula: C9H8N4O3S MolecularWeight: 252.24982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(=S)NC2=C(C=CC=N2)C(=O)N1

Isomeric SMILES

COC(=O)N1C(=S)NC2=C(C=CC=N2)C(=O)N1

InChI

InChI=1S/C9H8N4O3S/c1-16-9(15)13-8(17)11-6-5(7(14)12-13)3-2-4-10-6/h2-4H,1H3,(H,12,14)(H,10,11,17)