Vitas-M small molecule compound

3-chloro-N-(4-methoxybenzyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Catalog ID
STK342644
SMILES COc1ccc(cc1)CNC(=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 C22H16ClF3N4O2 MW 460.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClF3N4O2/c1-32-15-9-7-13(8-10-15)12-27-21(31)19-18(23)20-28-16(14-5-3-2-4-6-14)11-17(22(24,25)26)30(20)29-19/h2-11H,12H2,1H3,(H,27,31)
InChIKey
HEFIANIBHKKAKA-UHFFFAOYSA-N
Synonyms
314049-04-2
(3CHLORO5PHENYL7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL))N((4METHOXYPHENYL)METHYL)CARBOXAMIDE
314049042
3CHLORON((4METHOXYPHENYL)METHYL)5PHENYL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBOXAMIDE
3CHLORON(4METHOXYBENZYL)5PHENYL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBOXAMIDE
COC1=CC=C(C=C1)CNC(=O)C2=NN3C(=CC(=NC3=C2Cl)C4=CC=CC=C4)C(F)(F)F
InChI=1SC22H16ClF3N4O2c132159713(81015)122721(31)1918(23)202816(145324614)1117(22(2425)26)30(20)2919h211H12H21H3(H2731)
MFCD00981669
ZINC000000826534
ZINC00826534
ZINC826534

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Available files

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