ethyl 8-cyano-5-oxidanylidene-7-phenyl-2-sulfanylidene-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate

Systemtic Name: ethyl 8-cyano-5-oxidanylidene-7-phenyl-2-sulfanylidene-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate Openeye Name: ethyl 8-cyano-5-oxo-7-phenyl-2-thioxo-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate CAS Name: 8-cyano-5-oxo-7-phenyl-2-sulfanylidene-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 8-cyano-5-oxo-7-phenyl-2-sulfanylidene-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate Traditional Name: 8-cyano-5-keto-7-phenyl-2-thioxo-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid ethyl ester Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2NC(=S)NN2C1=O)C#N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C2NC(=S)NN2C1=O)C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H12N4O3S/c1-2-23-15(22)12-11(9-6-4-3-5-7-9)10(8-17)13-18-16(24)19-20(13)14(12)21/h3-7H,2H2,1H3,(H2,18,19,24)