Vitas-M small molecule compound
7-[5-bromo-2-(difluoromethoxy)phenyl]-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK914963
SMILES COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1cc(Br)ccc1OC(F)F)ncn2
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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 C21H18BrF2N5O3 MW 506.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrF2N5O3/c1-11-17(19(30)28-14-5-3-4-6-16(14)31-2)18(29-21(27-11)25-10-26-29)13-9-12(22)7-8-15(13)32-20(23)24/h3-10,18,20H,1-2H3,(H,28,30)(H,25,26,27)InChIKey
YNRDYFKOUVWKGU-UHFFFAOYSA-NSynonyms
7(5bromo2(difluoromethoxy)phenyl)N(2methoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
7(5bromo2(difluoromethoxy)phenyl)N(2methoxyphenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=C(C(N2C(=N1)N=CN2)C3=C(C=CC(=C3)Br)OC(F)F)C(=O)NC4=CC=CC=C4OC
InChI=1SC21H18BrF2N5O3c11117(19(30)2814534616(14)312)18(2921(2711)25102629)13912(22)7815(13)3220(23)24h3101820H12H3(H2830)(H252627)
MFCD14730359
ZINC000020133834
ZINC000020133837
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