Vitas-M small molecule compound
N-(4-bromo-2-fluorophenyl)-2-[3-(3-fluorobenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK900987
SMILES Brc1ccc(c(c1)F)NC(=O)Cn1cnc2c(c1=O)nnn2Cc1cccc(c1)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 C19H13BrF2N6O2 MW 475.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13BrF2N6O2/c20-12-4-5-15(14(22)7-12)24-16(29)9-27-10-23-18-17(19(27)30)25-26-28(18)8-11-2-1-3-13(21)6-11/h1-7,10H,8-9H2,(H,24,29)InChIKey
KAAICVNPVUIHQC-UHFFFAOYSA-NSynonyms
C1=CC(=CC(=C1)F)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=C(C=C(C=C4)Br)F)N=N2
InChI=1SC19H13BrF2N6O2c20124515(14(22)712)2416(29)92710231817(19(27)30)252628(18)81121313(21)611h1710H89H2(H2429)
MFCD18173782
N(4bromo2fluorophenyl)2(3((3fluorophenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(4bromo2fluorophenyl)2(3(3fluorobenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000044837193
ZINC44837193
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