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

Systemtic Name: 3-[2-(4-fluorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide Openeye Name: 3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide CAS Name: 3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-N-[3-(methylthio)phenyl]propanamide IUPAC Name: 3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide Traditional Name: 3-[1-(4-fluorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]-N-[3-(methylthio)phenyl]propionamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)F)CCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)F)CCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C20H20FN3O2S/c1-13-18(20(26)24(23-13)16-8-6-14(21)7-9-16)10-11-19(25)22-15-4-3-5-17(12-15)27-2/h3-9,12,23H,10-11H2,1-2H3,(H,22,25)