ethyl 1-(4-fluorophenyl)-6-oxidanylidene-4-[(phenylmethyl)amino]pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-6-oxidanylidene-4-[(phenylmethyl)amino]pyridazine-3-carboxylate Openeye Name: ethyl 4-(benzylamino)-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-6-oxo-4-[(phenylmethyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(benzylamino)-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C20H18FN3O3 MolecularWeight: 367.373623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NCC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NCC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H18FN3O3/c1-2-27-20(26)19-17(22-13-14-6-4-3-5-7-14)12-18(25)24(23-19)16-10-8-15(21)9-11-16/h3-12,22H,2,13H2,1H3