Vitas-M small molecule compound
2-[3-(3-fluorobenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Catalog ID
STK879442
SMILES COc1cc(NC(=O)Cn2cnc3c(c2=O)nnn3Cc2cccc(c2)F)cc(c1OC)OC
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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 C22H21FN6O5 MW 468.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN6O5/c1-32-16-8-15(9-17(33-2)20(16)34-3)25-18(30)11-28-12-24-21-19(22(28)31)26-27-29(21)10-13-5-4-6-14(23)7-13/h4-9,12H,10-11H2,1-3H3,(H,25,30)InChIKey
HCWMCUGIYGWTGP-UHFFFAOYSA-NSynonyms
2(3((3fluorophenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)N(345trimethoxyphenyl)acetamide
2(3(3fluorobenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)N(345trimethoxyphenyl)acetamide
COC1=CC(=CC(=C1OC)OC)NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC(=CC=C4)F
InChI=1SC22H21FN6O5c13216815(917(332)20(16)343)2518(30)112812242119(22(28)31)262729(21)101354614(23)713h4912H1011H213H3(H2530)
MFCD18170779
ZINC000040478226
ZINC40478226
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