ethyl 1-(4-fluorophenyl)-4-[(5-nitro-1,3-thiazol-2-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-4-[(5-nitro-1,3-thiazol-2-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-4-[(5-nitrothiazol-2-yl)amino]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4-[(5-nitro-2-thiazolyl)amino]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-4-[(5-nitro-1,3-thiazol-2-yl)amino]-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-6-keto-4-[(5-nitrothiazol-2-yl)amino]pyridazine-3-carboxylic acid ethyl ester Formula: C16H12FN5O5S MolecularWeight: 405.360383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC2=NC=C(S2)[N+](=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC2=NC=C(S2)[N+](=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C16H12FN5O5S/c1-2-27-15(24)14-11(19-16-18-8-13(28-16)22(25)26)7-12(23)21(20-14)10-5-3-9(17)4-6-10/h3-8H,2H2,1H3,(H,18,19)