Vitas-M small molecule compound
3-(4-chlorobenzyl)-6-{[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STL082337
SMILES COc1cc(OC)cc(c1)c1noc(n1)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 C22H18ClN7O4 MW 479.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN7O4/c1-32-16-7-14(8-17(9-16)33-2)20-25-18(34-27-20)11-29-12-24-21-19(22(29)31)26-28-30(21)10-13-3-5-15(23)6-4-13/h3-9,12H,10-11H2,1-2H3InChIKey
ZRVRFSLFZZCKJK-UHFFFAOYSA-NSynonyms
1040653-07-31040653073
3((4chlorophenyl)methyl)6((3(35dimethoxyphenyl)124oxadiazol5yl)methyl)triazolo(45d)pyrimidin7one
3(4chlorobenzyl)6((3(35dimethoxyphenyl)124oxadiazol5yl)methyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
3(4CHLOROBENZYL)6((3(35DIMETHOXYPHENYL)124OXADIAZOL5YL)METHYL)3H(123)TRIAZOLO(45D)PYRIMIDIN7(6H)ONE
COC1=CC(=CC(=C1)C2=NOC(=N2)CN3C=NC4=C(C3=O)N=NN4CC5=CC=C(C=C5)Cl)OC
InChI=1SC22H18ClN7O4c13216714(817(916)332)202518(342720)112912242119(22(29)31)262830(21)10133515(23)6413h3912H1011H212H3
MFCD11996087
ZINC000016842365
ZINC16842365
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