2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfanyl-1H-pyrazol-3-one

Systemtic Name: 2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfanyl-1H-pyrazol-3-one Openeye Name: 2-tert-butyl-5-methyl-4-(p-tolylsulfanyl)-1H-pyrazol-3-one CAS Name: 2-tert-butyl-5-methyl-4-[(4-methylphenyl)thio]-1H-pyrazol-3-one IUPAC Name: 2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfanyl-1H-pyrazol-3-one Traditional Name: 2-tert-butyl-5-methyl-4-(p-tolylthio)-3-pyrazolin-3-one Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(NN(C2=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(NN(C2=O)C(C)(C)C)C

InChI

InChI=1S/C15H20N2OS/c1-10-6-8-12(9-7-10)19-13-11(2)16-17(14(13)18)15(3,4)5/h6-9,16H,1-5H3