3,5-dimethyl-1-(phenylmethyl)pyrazole-4-sulfonyl chloride

Systemtic Name: 3,5-dimethyl-1-(phenylmethyl)pyrazole-4-sulfonyl chloride Openeye Name: 1-benzyl-3,5-dimethyl-pyrazole-4-sulfonyl chloride CAS Name: 3,5-dimethyl-1-(phenylmethyl)-4-pyrazolesulfonyl chloride IUPAC Name: 1-benzyl-3,5-dimethylpyrazole-4-sulfonyl chloride Traditional Name: 1-benzyl-3,5-dimethyl-pyrazole-4-sulfonyl chloride Formula: C12H13ClN2O2S MolecularWeight: 284.76182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)S(=O)(=O)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)S(=O)(=O)Cl

InChI

InChI=1S/C12H13ClN2O2S/c1-9-12(18(13,16)17)10(2)15(14-9)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3