3,5-dimethyl-4-(phenylsulfonylmethyl)-1H-pyrazole

Systemtic Name: 3,5-dimethyl-4-(phenylsulfonylmethyl)-1H-pyrazole Openeye Name: 4-(benzenesulfonylmethyl)-3,5-dimethyl-1H-pyrazole CAS Name: 4-(benzenesulfonylmethyl)-3,5-dimethyl-1H-pyrazole IUPAC Name: 4-(benzenesulfonylmethyl)-3,5-dimethyl-1H-pyrazole Traditional Name: 4-(besylmethyl)-3,5-dimethyl-1H-pyrazole Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1)C)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H14N2O2S/c1-9-12(10(2)14-13-9)8-17(15,16)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,13,14)