3-methyl-5-oxidanyl-5-(trichloromethyl)-4H-pyrazole-1-carbothioamide

Systemtic Name: 3-methyl-5-oxidanyl-5-(trichloromethyl)-4H-pyrazole-1-carbothioamide Openeye Name: 5-hydroxy-3-methyl-5-(trichloromethyl)-4H-pyrazole-1-carbothioamide CAS Name: 5-hydroxy-3-methyl-5-(trichloromethyl)-4H-pyrazole-1-carbothioamide IUPAC Name: 5-hydroxy-3-methyl-5-(trichloromethyl)-4H-pyrazole-1-carbothioamide Traditional Name: 5-hydroxy-3-methyl-5-(trichloromethyl)-2-pyrazoline-1-carbothioamide Formula: C6H8Cl3N3OS MolecularWeight: 276.57122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(Cl)(Cl)Cl)O)C(=S)N

Isomeric SMILES

CC1=NN(C(C1)(C(Cl)(Cl)Cl)O)C(=S)N

InChI

InChI=1S/C6H8Cl3N3OS/c1-3-2-5(13,6(7,8)9)12(11-3)4(10)14/h13H,2H2,1H3,(H2,10,14)