ethyl 1-(4-fluorophenyl)-6-oxidanylidene-4-(2-phenylbutanoylamino)pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-6-oxidanylidene-4-(2-phenylbutanoylamino)pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-6-oxo-4-(2-phenylbutanoylamino)pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-6-oxo-4-[(1-oxo-2-phenylbutyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-6-oxo-4-(2-phenylbutanoylamino)pyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-6-keto-4-(2-phenylbutanoylamino)pyridazine-3-carboxylic acid ethyl ester Formula: C23H22FN3O4 MolecularWeight: 423.436883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22FN3O4/c1-3-18(15-8-6-5-7-9-15)22(29)25-19-14-20(28)27(17-12-10-16(24)11-13-17)26-21(19)23(30)31-4-2/h5-14,18H,3-4H2,1-2H3,(H,25,29)