1-(4-bromophenyl)sulfonyl-3,5,5-trimethyl-4H-pyrazole

Systemtic Name: 1-(4-bromophenyl)sulfonyl-3,5,5-trimethyl-4H-pyrazole Openeye Name: 1-(4-bromophenyl)sulfonyl-3,5,5-trimethyl-4H-pyrazole CAS Name: 1-(4-bromophenyl)sulfonyl-3,5,5-trimethyl-4H-pyrazole IUPAC Name: 1-(4-bromophenyl)sulfonyl-3,5,5-trimethyl-4H-pyrazole Traditional Name: 1-brosyl-3,5,5-trimethyl-2-pyrazoline Formula: C12H15BrN2O2S MolecularWeight: 331.2287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C)C)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NN(C(C1)(C)C)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H15BrN2O2S/c1-9-8-12(2,3)15(14-9)18(16,17)11-6-4-10(13)5-7-11/h4-7H,8H2,1-3H3