Vitas-M small molecule compound
ethyl 4-({[3-(3-methoxybenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetyl}amino)benzoate
Catalog ID
STK879331
SMILES CCOC(=O)c1ccc(cc1)NC(=O)Cn1cnc2c(c1=O)nnn2Cc1cccc(c1)OC
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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 C23H22N6O5 MW 462.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O5/c1-3-34-23(32)16-7-9-17(10-8-16)25-19(30)13-28-14-24-21-20(22(28)31)26-27-29(21)12-15-5-4-6-18(11-15)33-2/h4-11,14H,3,12-13H2,1-2H3,(H,25,30)InChIKey
DJMAAWLIBKAFBA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC(=CC=C4)OC
ethyl4(((3(3methoxybenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetyl)amino)benzoate
ethyl4((2(3((3methoxyphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetyl)amino)benzoate
InChI=1SC23H22N6O5c133423(32)167917(10816)2519(30)132814242120(22(28)31)262729(21)121554618(1115)332h41114H31213H212H3(H2530)
MFCD18170678
ZINC000040478123
ZINC40478123
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