methyl 7-methyl-3-(4-methylphenyl)-4-oxidanylidene-5-(phenylcarbonylcarbamothioylamino)thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: methyl 7-methyl-3-(4-methylphenyl)-4-oxidanylidene-5-(phenylcarbonylcarbamothioylamino)thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: methyl 5-(benzoylcarbamothioylamino)-7-methyl-4-oxo-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 5-[[benzamido(sulfanylidene)methyl]amino]-7-methyl-3-(4-methylphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 5-(benzoylcarbamothioylamino)-7-methyl-3-(4-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 5-(benzoylthiocarbamoylamino)-4-keto-7-methyl-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylic acid methyl ester Formula: C24H20N4O4S2 MolecularWeight: 492.57

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(SC(=C3C(=N2)C(=O)OC)C)NC(=S)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(SC(=C3C(=N2)C(=O)OC)C)NC(=S)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N4O4S2/c1-13-9-11-16(12-10-13)28-22(30)18-17(19(27-28)23(31)32-3)14(2)34-21(18)26-24(33)25-20(29)15-7-5-4-6-8-15/h4-12H,1-3H3,(H2,25,26,29,33)