Vitas-M small molecule compound

ethyl 5-methyl-3-(piperidin-1-ylsulfonyl)-1H-pyrazole-4-carboxylate

Catalog ID
STL073098
SMILES CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCCCC1

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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 C12H19N3O4S MW 301.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N3O4S/c1-3-19-12(16)10-9(2)13-14-11(10)20(17,18)15-7-5-4-6-8-15/h3-8H2,1-2H3,(H,13,14)
InChIKey
JUBSSQQVIKNMEQ-UHFFFAOYSA-N
Synonyms
1299301-74-8
1299301748
CCOC(=O)C1=C(NN=C1S(=O)(=O)N2CCCCC2)C
CCOC(=O)c1c(C)(nH)nc1S(=O)(=O)N1CCCCC1
ETHYL3METHYL5(PIPERIDIN1YLSULFONYL)1HPYRAZOLE4CARBOXYLATE
ethyl5methyl3(piperidin1ylsulfonyl)1Hpyrazole4carboxylate
ethyl5methyl3piperidin1ylsulfonyl1Hpyrazole4carboxylate
InChI=1SC12H19N3O4Sc131912(16)109(2)131411(10)20(1718)157546815h38H212H3(H1314)
MFCD18194733
ZINC000057478204
ZINC57478204

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Available files

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