ethyl 5-methylsulfanyl-6-oxidanylidene-3-phenyl-1,2,4-triazine-1-carboxylate

Systemtic Name: ethyl 5-methylsulfanyl-6-oxidanylidene-3-phenyl-1,2,4-triazine-1-carboxylate Openeye Name: ethyl 5-methylsulfanyl-6-oxo-3-phenyl-1,2,4-triazine-1-carboxylate CAS Name: 5-(methylthio)-6-oxo-3-phenyl-1,2,4-triazine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methylsulfanyl-6-oxo-3-phenyl-1,2,4-triazine-1-carboxylate Traditional Name: 6-keto-5-(methylthio)-3-phenyl-1,2,4-triazine-1-carboxylic acid ethyl ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=O)C(=NC(=N1)C2=CC=CC=C2)SC

Isomeric SMILES

CCOC(=O)N1C(=O)C(=NC(=N1)C2=CC=CC=C2)SC

InChI

InChI=1S/C13H13N3O3S/c1-3-19-13(18)16-12(17)11(20-2)14-10(15-16)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3