ethyl 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxidanylidene-thieno[2,3-d]pyridazine-2-carboxylate

Systemtic Name: ethyl 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxidanylidene-thieno[2,3-d]pyridazine-2-carboxylate Openeye Name: ethyl 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxo-thieno[2,3-d]pyridazine-2-carboxylate CAS Name: 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxo-2-thieno[2,3-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxothieno[2,3-d]pyridazine-2-carboxylate Traditional Name: 6-ethyl-4-(4-fluorophenyl)-7-keto-3-methyl-thieno[2,3-d]pyridazine-2-carboxylic acid ethyl ester Formula: C18H17FN2O3S MolecularWeight: 360.402583

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C(=C(S2)C(=O)OCC)C)C(=N1)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=O)C2=C(C(=C(S2)C(=O)OCC)C)C(=N1)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN2O3S/c1-4-21-17(22)16-13(10(3)15(25-16)18(23)24-5-2)14(20-21)11-6-8-12(19)9-7-11/h6-9H,4-5H2,1-3H3