Vitas-M small molecule compound
N-(2-chloro-6-methylphenyl)-2-[3-(3,5-difluorobenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879320
SMILES Fc1cc(F)cc(c1)Cn1nnc2c1ncn(c2=O)CC(=O)Nc1c(C)cccc1Cl
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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 C20H15ClF2N6O2 MW 444.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClF2N6O2/c1-11-3-2-4-15(21)17(11)25-16(30)9-28-10-24-19-18(20(28)31)26-27-29(19)8-12-5-13(22)7-14(23)6-12/h2-7,10H,8-9H2,1H3,(H,25,30)InChIKey
IJBHELIRTDPRMG-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)Cl)NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC(=CC(=C4)F)F
InChI=1SC20H15ClF2N6O2c11132415(21)17(11)2516(30)92810241918(20(28)31)262729(19)812513(22)714(23)612h2710H89H21H3(H2530)
MFCD18170667
N(2chloro6methylphenyl)2(3((35difluorophenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(2chloro6methylphenyl)2(3(35difluorobenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040478112
ZINC40478112
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