ethyl 4,5-dimethyl-2-[[1-(3-methylphenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[1-(3-methylphenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[1-(m-tolyl)-4-oxo-pyridazine-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[[1-(3-methylphenyl)-4-oxo-3-pyridazinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[1-(3-methylphenyl)-4-oxopyridazine-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[4-keto-1-(m-tolyl)pyridazine-3-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=CC2=O)C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=CC2=O)C3=CC=CC(=C3)C

InChI

InChI=1S/C21H21N3O4S/c1-5-28-21(27)17-13(3)14(4)29-20(17)22-19(26)18-16(25)9-10-24(23-18)15-8-6-7-12(2)11-15/h6-11H,5H2,1-4H3,(H,22,26)