[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-1-phenyl-pyridazine-3-carboxylate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] 6-methyl-4-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-phenyl-3-pyridazinecarboxylic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] 6-methyl-4-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 4-keto-6-methyl-1-phenyl-pyridazine-3-carboxylic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3

InChI

InChI=1S/C23H23N3O4S/c1-16-8-10-19(11-9-16)31-13-12-24-21(28)15-30-23(29)22-20(27)14-17(2)26(25-22)18-6-4-3-5-7-18/h3-11,14H,12-13,15H2,1-2H3,(H,24,28)