ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylthiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylthiomorpholine-3-carboxylate Openeye Name: ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]thiomorpholine-3-carboxylate CAS Name: 4-[[1-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]thiomorpholine-3-carboxylate Traditional Name: 4-[1-(4-chlorophenyl)-4-keto-6-methyl-pyridazine-3-carbonyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C19H20ClN3O4S MolecularWeight: 421.8978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C2=NN(C(=CC2=O)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)C2=NN(C(=CC2=O)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O4S/c1-3-27-19(26)15-11-28-9-8-22(15)18(25)17-16(24)10-12(2)23(21-17)14-6-4-13(20)5-7-14/h4-7,10,15H,3,8-9,11H2,1-2H3