ethyl 3-(4-methylphenyl)-4-oxidanylidene-5-(2-propylpentanoylamino)thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 3-(4-methylphenyl)-4-oxidanylidene-5-(2-propylpentanoylamino)thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 4-oxo-5-(2-propylpentanoylamino)-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 3-(4-methylphenyl)-4-oxo-5-[(1-oxo-2-propylpentyl)amino]-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-methylphenyl)-4-oxo-5-(2-propylpentanoylamino)thieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 4-keto-5-(2-propylpentanoylamino)-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=C2C(=CS1)C(=NN(C2=O)C3=CC=C(C=C3)C)C(=O)OCC

Isomeric SMILES

CCCC(CCC)C(=O)NC1=C2C(=CS1)C(=NN(C2=O)C3=CC=C(C=C3)C)C(=O)OCC

InChI

InChI=1S/C24H29N3O4S/c1-5-8-16(9-6-2)21(28)25-22-19-18(14-32-22)20(24(30)31-7-3)26-27(23(19)29)17-12-10-15(4)11-13-17/h10-14,16H,5-9H2,1-4H3,(H,25,28)