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

Systemtic Name: 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxidanylidene-thieno[2,3-d]pyridazine-2-carboxylic acid Openeye Name: 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxo-thieno[2,3-d]pyridazine-2-carboxylic acid CAS Name: 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxo-2-thieno[2,3-d]pyridazinecarboxylic acid IUPAC Name: 6-ethyl-4-(4-fluorophenyl)-3-methyl-7-oxothieno[2,3-d]pyridazine-2-carboxylic acid Traditional Name: 6-ethyl-4-(4-fluorophenyl)-7-keto-3-methyl-thieno[2,3-d]pyridazine-2-carboxylic acid Formula: C16H13FN2O3S MolecularWeight: 332.349423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13FN2O3S/c1-3-19-15(20)14-11(8(2)13(23-14)16(21)22)12(18-19)9-4-6-10(17)7-5-9/h4-7H,3H2,1-2H3,(H,21,22)