4-[bis(fluoranyl)methylsulfanyl]-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide Openeye Name: 4-(difluoromethylsulfanyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide CAS Name: 4-(difluoromethylthio)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 4-(difluoromethylsulfanyl)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 4-(difluoromethylthio)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide Formula: C20H19F2N3OS MolecularWeight: 387.446166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C20H19F2N3OS/c1-13-18(14(2)25(24-13)16-6-4-3-5-7-16)12-23-19(26)15-8-10-17(11-9-15)27-20(21)22/h3-11,20H,12H2,1-2H3,(H,23,26)