4-(2-hydroxyethyl)-3-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrazol-5-one

Systemtic Name: 4-(2-hydroxyethyl)-3-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrazol-5-one Openeye Name: 4-(2-hydroxyethyl)-3-methyl-2-(p-tolylsulfonyl)-1H-pyrazol-5-one CAS Name: 4-(2-hydroxyethyl)-3-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrazol-5-one IUPAC Name: 4-(2-hydroxyethyl)-3-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrazol-5-one Traditional Name: 4-(2-hydroxyethyl)-5-methyl-1-tosyl-3-pyrazolin-3-one Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=O)N2)CCO)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=O)N2)CCO)C

InChI

InChI=1S/C13H16N2O4S/c1-9-3-5-11(6-4-9)20(18,19)15-10(2)12(7-8-16)13(17)14-15/h3-6,16H,7-8H2,1-2H3,(H,14,17)