N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-4-(trifluoromethylsulfanyl)benzamide Openeye Name: N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]-4-(trifluoromethylsulfanyl)benzamide CAS Name: N-[[3,5-dimethyl-1-(2-methylphenyl)-4-pyrazolyl]methyl]-4-(trifluoromethylthio)benzamide IUPAC Name: N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-4-(trifluoromethylsulfanyl)benzamide Traditional Name: N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]-4-(trifluoromethylthio)benzamide Formula: C21H20F3N3OS MolecularWeight: 419.46321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=O)C3=CC=C(C=C3)SC(F)(F)F)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=O)C3=CC=C(C=C3)SC(F)(F)F)C

InChI

InChI=1S/C21H20F3N3OS/c1-13-6-4-5-7-19(13)27-15(3)18(14(2)26-27)12-25-20(28)16-8-10-17(11-9-16)29-21(22,23)24/h4-11H,12H2,1-3H3,(H,25,28)