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

Systemtic Name: ethyl 1-(4-fluorophenyl)-4-(2-methylpropylamino)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-4-(isobutylamino)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4-(2-methylpropylamino)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-4-(2-methylpropylamino)-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4-(isobutylamino)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NCC(C)C)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NCC(C)C)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FN3O3/c1-4-24-17(23)16-14(19-10-11(2)3)9-15(22)21(20-16)13-7-5-12(18)6-8-13/h5-9,11,19H,4,10H2,1-3H3