Vitas-M small molecule compound
2-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL397793
SMILES Clc1c(C)n(nc1C(F)(F)F)Cc1nn2c(n1)c1c(nc2)sc2c1CCC2
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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 C16H12ClF3N6S MW 412.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClF3N6S/c1-7-12(17)13(16(18,19)20)24-25(7)5-10-22-14-11-8-3-2-4-9(8)27-15(11)21-6-26(14)23-10/h6H,2-5H2,1H3InChIKey
SDJGVWQSOZHICP-UHFFFAOYSA-NSynonyms
1005622-06-91005622069
2((4CHLORO5METHYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)METHYL)910DIHYDRO8HCYCLOPENTA(45)THIENO(32E)(124)TRIAZOLO(15C)PYRIMIDINE
CC1=C(C(=NN1CC2=NN3C=NC4=C(C3=N2)C5=C(S4)CCC5)C(F)(F)F)Cl
InChI=1SC16H12ClF3N6Sc1712(17)13(16(1819)20)2425(7)51022141183249(8)2715(11)21626(14)2310h6H25H21H3
MFCD04129630
ZINC000002788909
ZINC02788909
ZINC2788909
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