Vitas-M small molecule compound

{[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]sulfonyl}acetic acid

Catalog ID
STK350044
SMILES OC(=O)CS(=O)(=O)Cn1nc(c(c1C)Cl)C

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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 C8H11ClN2O4S MW 266.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11ClN2O4S/c1-5-8(9)6(2)11(10-5)4-16(14,15)3-7(12)13/h3-4H2,1-2H3,(H,12,13)
InChIKey
PSLOTKRMKSLYBG-UHFFFAOYSA-N
Synonyms
1006319-32-9
(((4chloro35dimethyl1Hpyrazol1yl)methyl)sulfonyl)aceticacid
1006319329
2(((4CHLORO35DIMETHYL1HPYRAZOL1YL)METHANE)SULFONYL)ACETICACID
2(((4CHLORO35DIMETHYLPYRAZOLYL)METHYL)SULFONYL)ACETICACID
2((4chloro35dimethylpyrazol1yl)methylsulfonyl)aceticacid
CC1=C(C(=NN1CS(=O)(=O)CC(=O)O)C)Cl
InChI=1SC8H11ClN2O4Sc158(9)6(2)11(105)416(1415)37(12)13h34H212H3(H1213)
MFCD05862148
ZINC000002554726
ZINC2554726

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Available files

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