Vitas-M small molecule compound
3-(2-chlorobenzyl)-6-(3-fluoro-4-methoxybenzyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STL125818
SMILES COc1ccc(cc1F)Cn1cnc2c(c1=O)nnn2Cc1ccccc1Cl
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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 C19H15ClFN5O2 MW 399.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClFN5O2/c1-28-16-7-6-12(8-15(16)21)9-25-11-22-18-17(19(25)27)23-24-26(18)10-13-4-2-3-5-14(13)20/h2-8,11H,9-10H2,1H3InChIKey
XQXDOZZXSDBSMV-UHFFFAOYSA-NSynonyms
3((2chlorophenyl)methyl)6((3fluoro4methoxyphenyl)methyl)triazolo(45d)pyrimidin7one
3(2chlorobenzyl)6(3fluoro4methoxybenzyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
COC1=C(C=C(C=C1)CN2C=NC3=C(C2=O)N=NN3CC4=CC=CC=C4Cl)F
InChI=1SC19H15ClFN5O2c128167612(815(16)21)92511221817(19(25)27)232426(18)1013423514(13)20h2811H910H21H3
MFCD20738244
ZINC000067259978
ZINC67259978
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