Vitas-M small molecule compound

1-(benzylsulfonyl)-4-chloro-3,5-dimethyl-1H-pyrazole

Catalog ID
STK469824
SMILES Cc1nn(c(c1Cl)C)S(=O)(=O)Cc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H13ClN2O2S MW 284.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13ClN2O2S/c1-9-12(13)10(2)15(14-9)18(16,17)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
InChIKey
MQHVZKSIDPGLLO-UHFFFAOYSA-N
Synonyms

1(benzylsulfonyl)4chloro35dimethyl1Hpyrazole
1benzylsulfonyl4chloro35dimethylpyrazole
4CHLORO35DIMETHYL1(BENZYLSULFONYL)PYRAZOLE
CC1=C(C(=NN1S(=O)(=O)CC2=CC=CC=C2)C)Cl
InChI=1SC12H13ClN2O2Sc1912(13)10(2)15(149)18(1617)8116435711h37H8H212H3
MFCD06080492
ZINC000017009371
ZINC17009371

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.