Vitas-M small molecule compound
3-(3-chlorophenyl)-6-{[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STL082353
SMILES COc1cc(OC)ccc1c1noc(n1)Cn1cnc2c(c1=O)nnn2c1cccc(c1)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 C21H16ClN7O4 MW 465.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN7O4/c1-31-14-6-7-15(16(9-14)32-2)19-24-17(33-26-19)10-28-11-23-20-18(21(28)30)25-27-29(20)13-5-3-4-12(22)8-13/h3-9,11H,10H2,1-2H3InChIKey
KMNGDRANEXVGHS-UHFFFAOYSA-NSynonyms
1040645-62-21040645622
3(3chlorophenyl)6((3(24dimethoxyphenyl)124oxadiazol5yl)methyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
3(3CHLOROPHENYL)6((3(24DIMETHOXYPHENYL)124OXADIAZOL5YL)METHYL)3H(123)TRIAZOLO(45D)PYRIMIDIN7(6H)ONE
3(3chlorophenyl)6((3(24dimethoxyphenyl)124oxadiazol5yl)methyl)triazolo(45d)pyrimidin7one
COC1=CC(=C(C=C1)C2=NOC(=N2)CN3C=NC4=C(C3=O)N=NN4C5=CC(=CC=C5)Cl)OC
InChI=1SC21H16ClN7O4c131146715(16(914)322)192417(332619)102811232018(21(28)30)252729(20)1353412(22)813h3911H10H212H3
MFCD11996465
ZINC000016843165
ZINC16843165
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