2-(4-chlorophenyl)sulfanylethyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: 6-keto-4,5-dihydro-1H-pyridazine-3-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C(=O)OCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CC(=O)NN=C1C(=O)OCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H13ClN2O3S/c14-9-1-3-10(4-2-9)20-8-7-19-13(18)11-5-6-12(17)16-15-11/h1-4H,5-8H2,(H,16,17)