Vitas-M small molecule compound
2-[3-(4-chlorobenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(4-methoxybenzyl)acetamide
Catalog ID
STK900966
SMILES COc1ccc(cc1)CNC(=O)Cn1cnc2c(c1=O)nnn2Cc1ccc(cc1)Cl
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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 C21H19ClN6O3 MW 438.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN6O3/c1-31-17-8-4-14(5-9-17)10-23-18(29)12-27-13-24-20-19(21(27)30)25-26-28(20)11-15-2-6-16(22)7-3-15/h2-9,13H,10-12H2,1H3,(H,23,29)InChIKey
CMVHLZTWSCECJC-UHFFFAOYSA-NSynonyms
2(3((4chlorophenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)N((4methoxyphenyl)methyl)acetamide
2(3(4chlorobenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)N(4methoxybenzyl)acetamide
COC1=CC=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC=C(C=C4)Cl
InChI=1SC21H19ClN6O3c131178414(5917)102318(29)122713242019(21(27)30)252628(20)11152616(22)7315h2913H1012H21H3(H2329)
MFCD18173761
ZINC000044837092
ZINC44837092
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