2-(4-fluorophenyl)-4-[N-(3-methoxypropyl)-C-methyl-carbonimidoyl]-5-phenyl-4H-pyrazol-3-one

Systemtic Name: 2-(4-fluorophenyl)-4-[N-(3-methoxypropyl)-C-methyl-carbonimidoyl]-5-phenyl-4H-pyrazol-3-one Openeye Name: 2-(4-fluorophenyl)-4-[N-(3-methoxypropyl)-C-methyl-carbonimidoyl]-5-phenyl-4H-pyrazol-3-one CAS Name: 2-(4-fluorophenyl)-4-[1-(3-methoxypropylimino)ethyl]-5-phenyl-4H-pyrazol-3-one IUPAC Name: 2-(4-fluorophenyl)-4-[N-(3-methoxypropyl)-C-methylcarbonimidoyl]-5-phenyl-4H-pyrazol-3-one Traditional Name: 2-(4-fluorophenyl)-4-[N-(3-methoxypropyl)-C-methyl-carbonimidoyl]-5-phenyl-2-pyrazolin-3-one Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCCOC)C1C(=NN(C1=O)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CC(=NCCCOC)C1C(=NN(C1=O)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H22FN3O2/c1-15(23-13-6-14-27-2)19-20(16-7-4-3-5-8-16)24-25(21(19)26)18-11-9-17(22)10-12-18/h3-5,7-12,19H,6,13-14H2,1-2H3