Vitas-M small molecule compound
2-(pyrimidin-2-yl)-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene
Catalog ID
STK693953
SMILES FC(C1(C2C=CC(N1c1ncccn1)C2)C(F)(F)F)(F)F
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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 C12H9F6N3 MW 309.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9F6N3/c13-11(14,15)10(12(16,17)18)7-2-3-8(6-7)21(10)9-19-4-1-5-20-9/h1-5,7-8H,6H2InChIKey
AKOOSSRAIBCESU-UHFFFAOYSA-NSynonyms
2(pyrimidin2yl)33bis(trifluoromethyl)2azabicyclo(221)hept5ene
3pyrimidin2yl22bis(trifluoromethyl)3azabicyclo(221)hept5ene
C1C2C=CC1N(C2(C(F)(F)F)C(F)(F)F)C3=NC=CC=N3
InChI=1SC12H9F6N3c1311(1415)10(12(1617)18)7238(67)21(10)919415209h1578H6H2
MFCD12966015
ZINC000100241663
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