Vitas-M small molecule compound
[3-bromo-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methanone
Catalog ID
STK959317
SMILES O=C(c1nn2c(c1Br)nc(cc2C(F)(F)F)c1ccccc1)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 C21H19BrF3N5O MW 494.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrF3N5O/c22-17-18(20(31)29-10-9-28-8-4-7-14(28)12-29)27-30-16(21(23,24)25)11-15(26-19(17)30)13-5-2-1-3-6-13/h1-3,5-6,11,14H,4,7-10,12H2InChIKey
OIHDSMHPHPZZFH-UHFFFAOYSA-NSynonyms
438531-25-0(3bromo5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(hexahydropyrrolo(12a)pyrazin2(1H)yl)methanone
346788ahexahydro1Hpyrrolo(12a)pyrazin2yl(3bromo5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)methanone
438531250
C1CC2CN(CCN2C1)C(=O)C3=NN4C(=CC(=NC4=C3Br)C5=CC=CC=C5)C(F)(F)F
InChI=1SC21H19BrF3N5Oc221718(20(31)291092884714(28)1229)273016(21(2324)25)1115(2619(17)30)135213613h13561114H471012H2
MFCD02055821
ZINC000008444801
ZINC000008444803
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