ethyl 4-(3,3-diphenylpropanoylamino)-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(3,3-diphenylpropanoylamino)-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(3,3-diphenylpropanoylamino)-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-6-oxo-4-[(1-oxo-3,3-diphenylpropyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,3-diphenylpropanoylamino)-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(3,3-diphenylpropanoylamino)-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C28H24FN3O4 MolecularWeight: 485.506263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H24FN3O4/c1-2-36-28(35)27-24(18-26(34)32(31-27)22-15-13-21(29)14-16-22)30-25(33)17-23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-16,18,23H,2,17H2,1H3,(H,30,33)