Vitas-M small molecule compound

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

Catalog ID
STK349691
SMILES OC(=O)CSCn1nc(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 C8H11ClN2O2S MW 234.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11ClN2O2S/c1-5-8(9)6(2)11(10-5)4-14-3-7(12)13/h3-4H2,1-2H3,(H,12,13)
InChIKey
KLEFKPOMCOXBCL-UHFFFAOYSA-N
Synonyms
1006436-36-7
(((4chloro35dimethyl1Hpyrazol1yl)methyl)sulfanyl)aceticacid
(((4CHLORO35DIMETHYL1HPYRAZOL1YL)METHYL)THIO)ACETICACID
1006436367
2(((4CHLORO35DIMETHYL1HPYRAZOL1YL)METHYL)SULFANYL)ACETICACID
2((4chloro35dimethylpyrazol1yl)methylsulfanyl)aceticacid
2((4CHLORO35DIMETHYLPYRAZOLYL)METHYLTHIO)ACETICACID
CC1=C(C(=NN1CSCC(=O)O)C)Cl
InChI=1SC8H11ClN2O2Sc158(9)6(2)11(105)41437(12)13h34H212H3(H1213)
MFCD04970054
ZINC000002537827
ZINC2537827

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Available files

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