5-(4-methylphenyl)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazole-2-carbothioamide

Systemtic Name: 5-(4-methylphenyl)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazole-2-carbothioamide Openeye Name: 3-hydroxy-5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazole-2-carbothioamide CAS Name: 3-hydroxy-5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazole-2-carbothioamide IUPAC Name: 3-hydroxy-5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazole-2-carbothioamide Traditional Name: 5-hydroxy-3-(p-tolyl)-5-(trifluoromethyl)-3-pyrazoline-1-carbothioamide Formula: C12H12F3N3OS MolecularWeight: 303.30339

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(N(N2)C(=S)N)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(N(N2)C(=S)N)(C(F)(F)F)O

InChI

InChI=1S/C12H12F3N3OS/c1-7-2-4-8(5-3-7)9-6-11(19,12(13,14)15)18(17-9)10(16)20/h2-6,17,19H,1H3,(H2,16,20)