(4-methylsulfanylphenyl) 1-methyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: (4-methylsulfanylphenyl) 1-methyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: (4-methylsulfanylphenyl) 1-methyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-methyl-6-oxo-3-pyridazinecarboxylic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 1-methyl-6-oxopyridazine-3-carboxylate Traditional Name: 6-keto-1-methyl-pyridazine-3-carboxylic acid [4-(methylthio)phenyl] ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)OC2=CC=C(C=C2)SC

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)OC2=CC=C(C=C2)SC

InChI

InChI=1S/C13H12N2O3S/c1-15-12(16)8-7-11(14-15)13(17)18-9-3-5-10(19-2)6-4-9/h3-8H,1-2H3