Vitas-M small molecule compound

1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

Catalog ID
STL404319
SMILES CCn1nc(c(c1C)S(=O)(=O)N1N=C(CC1(O)C(F)(F)F)C)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 C12H17F3N4O3S MW 354.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17F3N4O3S/c1-5-18-9(4)10(8(3)17-18)23(21,22)19-11(20,12(13,14)15)6-7(2)16-19/h20H,5-6H2,1-4H3
InChIKey
UPKUFCAVBLTCCJ-UHFFFAOYSA-N
Synonyms
1005596-46-2
1((1ethyl35dimethyl1Hpyrazol4yl)sulfonyl)3methyl5(trifluoromethyl)45dihydro1Hpyrazol5ol
1005596462
2(1ethyl35dimethylpyrazol4yl)sulfonyl5methyl3(trifluoromethyl)4Hpyrazol3ol
CCN1C(=C(C(=N1)C)S(=O)(=O)N2C(CC(=N2)C)(C(F)(F)F)O)C
InChI=1SC12H17F3N4O3Sc15189(4)10(8(3)1718)23(2122)1911(2012(1314)15)67(2)1619h20H56H214H3
MFCD06195996
ZINC000017073272
ZINC000017073273

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Available files

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