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

Systemtic Name: ethyl 1-(4-fluorophenyl)-4-[methyl-(phenylmethyl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[benzyl(methyl)amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4-[methyl-(phenylmethyl)amino]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[benzyl(methyl)amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[benzyl(methyl)amino]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1N(C)CC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1N(C)CC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O3/c1-3-28-21(27)20-18(24(2)14-15-7-5-4-6-8-15)13-19(26)25(23-20)17-11-9-16(22)10-12-17/h4-13H,3,14H2,1-2H3