N-(2-fluorophenyl)-5-oxidanyl-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazole-1-carbothioamide

Systemtic Name: N-(2-fluorophenyl)-5-oxidanyl-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazole-1-carbothioamide Openeye Name: N-(2-fluorophenyl)-5-hydroxy-3-isopropyl-5-(trifluoromethyl)-4H-pyrazole-1-carbothioamide CAS Name: N-(2-fluorophenyl)-5-hydroxy-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazole-1-carbothioamide IUPAC Name: N-(2-fluorophenyl)-5-hydroxy-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazole-1-carbothioamide Traditional Name: N-(2-fluorophenyl)-5-hydroxy-3-isopropyl-5-(trifluoromethyl)-2-pyrazoline-1-carbothioamide Formula: C14H15F4N3OS MolecularWeight: 349.347013

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(C1)(C(F)(F)F)O)C(=S)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)C1=NN(C(C1)(C(F)(F)F)O)C(=S)NC2=CC=CC=C2F

InChI

InChI=1S/C14H15F4N3OS/c1-8(2)11-7-13(22,14(16,17)18)21(20-11)12(23)19-10-6-4-3-5-9(10)15/h3-6,8,22H,7H2,1-2H3,(H,19,23)