Vitas-M small molecule compound

1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(2,4-dimethoxyphenyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

Catalog ID
STL439969
SMILES COc1cc(OC)ccc1C1=NN(C(C1)(O)C(F)(F)F)c1scc(n1)c1ccc(cc1)Br

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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 C21H17BrF3N3O3S MW 528.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrF3N3O3S/c1-30-14-7-8-15(18(9-14)31-2)16-10-20(29,21(23,24)25)28(27-16)19-26-17(11-32-19)12-3-5-13(22)6-4-12/h3-9,11,29H,10H2,1-2H3
InChIKey
NPWDESKNXPLGFG-UHFFFAOYSA-N
Synonyms

1(4(4bromophenyl)13thiazol2yl)3(24dimethoxyphenyl)5(trifluoromethyl)45dihydro1Hpyrazol5ol
2(4(4BROMOPHENYL)13THIAZOL2YL)5(24DIMETHOXYPHENYL)3(TRIFLUOROMETHYL)4HPYRAZOL3OL
COC1=CC(=C(C=C1)C2=NN(C(C2)(C(F)(F)F)O)C3=NC(=CS3)C4=CC=C(C=C4)Br)OC
InChI=1SC21H17BrF3N3O3Sc130147815(18(914)312)161020(2921(2324)25)28(2716)192617(113219)123513(22)6412h391129H10H212H3
MFCD07773400
ZINC000008753890
ZINC000008753893

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Available files

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