1-Methyl-5-[(phenylmethyl)sulfonyl]-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile
CAS Registry Number®
318517-76-9
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CAS Name
1-Methyl-5-[(phenylmethyl)sulfonyl]-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrileMolecular Formula
C13H10F3N3O2SMolecular Mass
329.30Cite this Page
1-Methyl-5-[(phenylmethyl)sulfonyl]-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=318517-76-9 (retrieved ) (CAS RN: 318517-76-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H10F3N3O2S/c1-19-12(10(7-17)11(18-19)13(14,15)16)22(20,21)8-9-5-3-2-4-6-9/h2-6H,8H2,1H3
InChIKey
InChIKey=WTZUQRNFLXZBQB-UHFFFAOYSA-N
SMILES
C(#N)C1=C(S(CC2=CC=CC=C2)(=O)=O)N(C)N=C1C(F)(F)F
Canonical SMILES
N#CC=1C(=NN(C1S(=O)(=O)CC=2C=CC=CC2)C)C(F)(F)F
Other Names for this Substance
- 1H-Pyrazole-4-carbonitrile, 1-methyl-5-[(phenylmethyl)sulfonyl]-3-(trifluoromethyl)-
- 1-Methyl-5-[(phenylmethyl)sulfonyl]-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile