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

Systemtic Name: ethyl 5-acetamido-3-(4-ethoxyphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 5-acetamido-3-(4-ethoxyphenyl)-4-oxo-thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 5-acetamido-3-(4-ethoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetamido-3-(4-ethoxyphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 5-acetamido-4-keto-3-p-phenetyl-thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(SC=C3C(=N2)C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(SC=C3C(=N2)C(=O)OCC)NC(=O)C

InChI

InChI=1S/C19H19N3O5S/c1-4-26-13-8-6-12(7-9-13)22-18(24)15-14(10-28-17(15)20-11(3)23)16(21-22)19(25)27-5-2/h6-10H,4-5H2,1-3H3,(H,20,23)