ethyl 5-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]-3-(4-methylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 5-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]-3-(4-methylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 5-[(4-ethoxy-4-oxo-butanoyl)amino]-4-oxo-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 5-[(4-ethoxy-1,4-dioxobutyl)amino]-3-(4-methylphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-ethoxy-4-oxobutanoyl)amino]-3-(4-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 5-[(4-ethoxy-4-keto-butanoyl)amino]-4-keto-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O6S/c1-4-30-17(27)11-10-16(26)23-20-18-15(12-32-20)19(22(29)31-5-2)24-25(21(18)28)14-8-6-13(3)7-9-14/h6-9,12H,4-5,10-11H2,1-3H3,(H,23,26)