Vitas-M small molecule compound
cyclohexyl 7-[5-bromo-2-(difluoromethoxy)phenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL193596
SMILES FC(Oc1ccc(cc1C1C(=C(C)Nc2n1ncn2)C(=O)OC1CCCCC1)Br)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 C20H21BrF2N4O3 MW 483.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrF2N4O3/c1-11-16(18(28)29-13-5-3-2-4-6-13)17(27-20(26-11)24-10-25-27)14-9-12(21)7-8-15(14)30-19(22)23/h7-10,13,17,19H,2-6H2,1H3,(H,24,25,26)InChIKey
MTUGLZORUCRUMW-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=C(C=CC(=C3)Br)OC(F)F)C(=O)OC4CCCCC4
cyclohexyl7(5bromo2(difluoromethoxy)phenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxylate
cyclohexyl7(5bromo2(difluoromethoxy)phenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
InChI=1SC20H21BrF2N4O3c11116(18(28)29135324613)17(2720(2611)24102527)14912(21)7815(14)3019(22)23h710131719H26H21H3(H242526)
MFCD22391120
ZINC000072333655
ZINC000072333656
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