Vitas-M small molecule compound
2-[(2-chloro-4-fluorobenzyl)sulfanyl]-1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Catalog ID
STK446841
SMILES Fc1ccc(c(c1)Cl)CSCC(=O)N1N=C(CC1(O)C(F)(F)F)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 C14H13ClF4N2O2S MW 384.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClF4N2O2S/c1-8-5-13(23,14(17,18)19)21(20-8)12(22)7-24-6-9-2-3-10(16)4-11(9)15/h2-4,23H,5-7H2,1H3InChIKey
JECWKGBCICLPSI-UHFFFAOYSA-NSynonyms
2((2chloro4fluorobenzyl)sulfanyl)1(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)ethanone
2((2chloro4fluorophenyl)methylsulfanyl)1(5hydroxy3methyl5(trifluoromethyl)4Hpyrazol1yl)ethanone
2((2CHLORO4FLUOROPHENYL)METHYLTHIO)1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)(2PYRAZOLINYL))ETHAN1ONE
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)CSCC2=C(C=C(C=C2)F)Cl
InChI=1SC14H13ClF4N2O2Sc18513(2314(1718)19)21(208)12(22)724692310(16)411(9)15h2423H57H21H3
MFCD04059019
ZINC000006394232
ZINC000006394825
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