ethyl 4-[(4-butoxyphenyl)carbonylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(4-butoxyphenyl)carbonylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(4-butoxybenzoyl)amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[[(4-butoxyphenyl)-oxomethyl]amino]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-butoxybenzoyl)amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(4-butoxybenzoyl)amino]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C24H24FN3O5 MolecularWeight: 453.462863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H24FN3O5/c1-3-5-14-33-19-12-6-16(7-13-19)23(30)26-20-15-21(29)28(18-10-8-17(25)9-11-18)27-22(20)24(31)32-4-2/h6-13,15H,3-5,14H2,1-2H3,(H,26,30)