N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-[2-(4-fluorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]propanamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-[2-(4-fluorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]propanamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]propanamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]propanamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]propanamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-3-[1-(4-fluorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]propionamide Formula: C21H21F2N3O2 MolecularWeight: 385.407146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)CCC2=C(NN(C2=O)C3=CC=C(C=C3)F)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)CCC2=C(NN(C2=O)C3=CC=C(C=C3)F)C)F

InChI

InChI=1S/C21H21F2N3O2/c1-13-11-15(3-9-19(13)23)12-24-20(27)10-8-18-14(2)25-26(21(18)28)17-6-4-16(22)5-7-17/h3-7,9,11,25H,8,10,12H2,1-2H3,(H,24,27)