1,3,5-trimethyl-4-(phenylsulfonylmethyl)pyrazole

Systemtic Name: 1,3,5-trimethyl-4-(phenylsulfonylmethyl)pyrazole Openeye Name: 4-(benzenesulfonylmethyl)-1,3,5-trimethyl-pyrazole CAS Name: 4-(benzenesulfonylmethyl)-1,3,5-trimethylpyrazole IUPAC Name: 4-(benzenesulfonylmethyl)-1,3,5-trimethylpyrazole Traditional Name: 4-(besylmethyl)-1,3,5-trimethyl-pyrazole Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1C)C)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2O2S/c1-10-13(11(2)15(3)14-10)9-18(16,17)12-7-5-4-6-8-12/h4-8H,9H2,1-3H3