Vitas-M small molecule compound

ethyl 4-{[3-chloro-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STK340554
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccccc1

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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 C21H19ClF3N5O3 MW 481.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClF3N5O3/c1-2-33-20(32)29-10-8-28(9-11-29)19(31)17-16(22)18-26-14(13-6-4-3-5-7-13)12-15(21(23,24)25)30(18)27-17/h3-7,12H,2,8-11H2,1H3
InChIKey
CJDVIJFEMCKAAH-UHFFFAOYSA-N
Synonyms
717827-76-4
717827764
CCOC(=O)N1CCN(CC1)C(=O)C2=NN3C(=CC(=NC3=C2Cl)C4=CC=CC=C4)C(F)(F)F
ETHYL4((3CHLORO5PHENYL7(TRIFLUOROMETHYL)8HYDROPYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)PIPERAZINECARBOXYLATE
ethyl4((3chloro5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)piperazine1carboxylate
ETHYL4(3CHLORO5PHENYL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBONYL)PIPERAZINE1CARBOXYLATE
InChI=1SC21H19ClF3N5O3c123320(32)2910828(91129)19(31)1716(22)182614(136435713)1215(21(2324)25)30(18)2717h3712H2811H21H3
MFCD06005913
ZINC000012845499
ZINC12845499

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Available files

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