ethyl 1-(4-fluorophenyl)-6-oxidanylidene-4-(thiophen-2-ylcarbonylamino)pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-6-oxidanylidene-4-(thiophen-2-ylcarbonylamino)pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-6-oxo-4-(thiophene-2-carbonylamino)pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-6-oxo-4-[[oxo(thiophen-2-yl)methyl]amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-6-oxo-4-(thiophene-2-carbonylamino)pyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-6-keto-4-(2-thenoylamino)pyridazine-3-carboxylic acid ethyl ester Formula: C18H14FN3O4S MolecularWeight: 387.384863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FN3O4S/c1-2-26-18(25)16-13(20-17(24)14-4-3-9-27-14)10-15(23)22(21-16)12-7-5-11(19)6-8-12/h3-10H,2H2,1H3,(H,20,24)