Vitas-M small molecule compound

1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid

Catalog ID
STK633222
SMILES OC(=O)c1c(C)nn(c1C)C1CCS(=O)(=O)C1

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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 C10H14N2O4S MW 258.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H14N2O4S/c1-6-9(10(13)14)7(2)12(11-6)8-3-4-17(15,16)5-8/h8H,3-5H2,1-2H3,(H,13,14)
InChIKey
AZWKPIJIXFGFHH-UHFFFAOYSA-N
Synonyms
1134555-25-1
1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazole4carboxylicacid
1(11DIOXO1E6THIOLAN3YL)35DIMETHYLPYRAZOLE4CARBOXYLICACID
1(11DIOXO1L(6)THIOLAN3YL)35DIMETHYLPYRAZOLE4CARBOXYLICACID
1(11DIOXOTETRAHYDRO1LAMBDA6THIOPHEN3YL)35DIMETHYL1HPYRAZOLE4CARBOXYLICACID
1(11DIOXOTHIOLAN3YL)35DIMETHYLPYRAZOLE4CARBOXYLICACID
1134555251
35DIMETHYL1(11DIOXOTETRAHYDROTHIOPHEN3YL)1HPYRAZOLE4CARBOXYLICACID
CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)C(=O)O
InChI=1SC10H14N2O4Sc169(10(13)14)7(2)12(116)83417(1516)58h8H35H212H3(H1314)
MFCD09863869
ZINC000011919346
ZINC000011919347

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Available files

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