Vitas-M small molecule compound
octahydro-2H-quinolizin-1-ylmethyl 3-chloro-5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
Catalog ID
STK679932
SMILES O=C(c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccco1)OCC1CCCN2C1CCCC2
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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 C22H22ClF3N4O3 MW 482.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClF3N4O3/c23-18-19(21(31)33-12-13-5-3-9-29-8-2-1-6-15(13)29)28-30-17(22(24,25)26)11-14(27-20(18)30)16-7-4-10-32-16/h4,7,10-11,13,15H,1-3,5-6,8-9,12H2InChIKey
ISTQUAPICYMORV-UHFFFAOYSA-NSynonyms
(1R9AS)OCTAHYDRO2HQUINOLIZIN1YLMETHYL3CHLORO5(FURAN2YL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBOXYLATE
(6AZABICYCLO(440)DEC2YL)METHYL3CHLORO5(2FURYL)7(TRIFLUOROMETHYL)8HYDROPYRAZOLO(15A)PYRIMIDINE2CARBOXYLATE
23467899aoctahydro1Hquinolizin1ylmethyl3chloro5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxylate
C1CCN2CCCC(C2C1)COC(=O)C3=NN4C(=CC(=NC4=C3Cl)C5=CC=CO5)C(F)(F)F
InChI=1SC22H22ClF3N4O3c231819(21(31)33121353929821615(13)29)283017(22(2425)26)1114(2720(18)30)1674103216h4710111315H13568912H2
MFCD03766488
octahydro2Hquinolizin1ylmethyl3chloro5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxylate
ZINC000001073197
ZINC000015276483
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