Vitas-M small molecule compound
[5-(1,3-benzodioxol-5-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methanone
Catalog ID
STK959283
SMILES O=C(c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc2c(c1)OCO2)N1CCN2C(C1)CCC2
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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 C22H20F3N5O3 MW 459.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3N5O3/c23-22(24,25)19-9-15(13-3-4-17-18(8-13)33-12-32-17)26-20-10-16(27-30(19)20)21(31)29-7-6-28-5-1-2-14(28)11-29/h3-4,8-10,14H,1-2,5-7,11-12H2InChIKey
XWJAPSMTJORAJT-UHFFFAOYSA-NSynonyms
438530-81-5(5(13benzodioxol5yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(hexahydropyrrolo(12a)pyrazin2(1H)yl)methanone
346788ahexahydro1Hpyrrolo(12a)pyrazin2yl(5(13benzodioxol5yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)methanone
438530815
5(13BENZODIOXOL5YL)2(HEXAHYDROPYRROLO(12A)PYRAZIN2(1H)YLCARBONYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE
C1CC2CN(CCN2C1)C(=O)C3=NN4C(=CC(=NC4=C3)C5=CC6=C(C=C5)OCO6)C(F)(F)F
InChI=1SC22H20F3N5O3c2322(2425)19915(13341718(813)33123217)26201016(2730(19)20)21(31)29762851214(28)1129h3481014H12571112H2
MFCD02055667
ZINC000008455832
ZINC000008455833
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