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

Systemtic Name: 4-(2-hydroxyethyl)-3-methyl-2-(phenylsulfonyl)-1H-pyrazol-5-one Openeye Name: 2-(benzenesulfonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrazol-5-one CAS Name: 2-(benzenesulfonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrazol-5-one IUPAC Name: 2-(benzenesulfonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrazol-5-one Traditional Name: 1-besyl-4-(2-hydroxyethyl)-5-methyl-3-pyrazolin-3-one Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1S(=O)(=O)C2=CC=CC=C2)CCO

Isomeric SMILES

CC1=C(C(=O)NN1S(=O)(=O)C2=CC=CC=C2)CCO

InChI

InChI=1S/C12H14N2O4S/c1-9-11(7-8-15)12(16)13-14(9)19(17,18)10-5-3-2-4-6-10/h2-6,15H,7-8H2,1H3,(H,13,16)