(3,5-dimethyl-5-oxidanyl-4H-pyrazol-1-yl)-(4-methylphenyl)methanethione

Systemtic Name: (3,5-dimethyl-5-oxidanyl-4H-pyrazol-1-yl)-(4-methylphenyl)methanethione Openeye Name: (5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-(p-tolyl)methanethione CAS Name: (5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-(4-methylphenyl)methanethione IUPAC Name: (5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-(4-methylphenyl)methanethione Traditional Name: (5-hydroxy-3,5-dimethyl-2-pyrazolin-1-yl)-(p-tolyl)methanethione Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C)O)C(=S)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=NN(C(C1)(C)O)C(=S)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H16N2OS/c1-9-4-6-11(7-5-9)12(17)15-13(3,16)8-10(2)14-15/h4-7,16H,8H2,1-3H3