ethyl 5-acetamido-3-(3,4-dimethylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 5-acetamido-3-(3,4-dimethylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 5-acetamido-3-(3,4-dimethylphenyl)-4-oxo-thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 5-acetamido-3-(3,4-dimethylphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetamido-3-(3,4-dimethylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 5-acetamido-3-(3,4-dimethylphenyl)-4-keto-thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C19H19N3O4S/c1-5-26-19(25)16-14-9-27-17(20-12(4)23)15(14)18(24)22(21-16)13-7-6-10(2)11(3)8-13/h6-9H,5H2,1-4H3,(H,20,23)