ethyl 3-(4-methoxyphenyl)-4-oxidanylidene-5-(2-thiophen-2-ylethanoylamino)thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 3-(4-methoxyphenyl)-4-oxidanylidene-5-(2-thiophen-2-ylethanoylamino)thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 3-(4-methoxyphenyl)-4-oxo-5-[[2-(2-thienyl)acetyl]amino]thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 3-(4-methoxyphenyl)-4-oxo-5-[(1-oxo-2-thiophen-2-ylethyl)amino]-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-methoxyphenyl)-4-oxo-5-[(2-thiophen-2-ylacetyl)amino]thieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 4-keto-3-(4-methoxyphenyl)-5-[[2-(2-thienyl)acetyl]amino]thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C22H19N3O5S2 MolecularWeight: 469.53336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)CC3=CC=CS3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)CC3=CC=CS3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H19N3O5S2/c1-3-30-22(28)19-16-12-32-20(23-17(26)11-15-5-4-10-31-15)18(16)21(27)25(24-19)13-6-8-14(29-2)9-7-13/h4-10,12H,3,11H2,1-2H3,(H,23,26)