Vitas-M small molecule compound
7-benzyl-8-bromo-3-methyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834021
SMILES C=CCn1c(=O)n(C)c2c(c1=O)n(Cc1ccccc1)c(n2)Br
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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 C16H15BrN4O2 MW 375.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O2/c1-3-9-20-14(22)12-13(19(2)16(20)23)18-15(17)21(12)10-11-7-5-4-6-8-11/h3-8H,1,9-10H2,2H3InChIKey
PKQJWRKAOCRZPY-UHFFFAOYSA-NSynonyms
114145-27-6114145276
1allyl7benzyl8bromo3methyl1Hpurine26(3H7H)dione
1ALLYL7BENZYL8BROMO3METHYL37DIHYDROPURINE26DIONE
7benzyl8bromo3methyl1(prop2en1yl)37dihydro1Hpurine26dione
7BENZYL8BROMO3METHYL1PROP2ENYLPURINE26DIONE
8BROMO3METHYL7BENZYL1PROP2ENYL137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)CC=C)N(C(=N2)Br)CC3=CC=CC=C3
InChI=1SC16H15BrN4O2c1392014(22)1213(19(2)16(20)23)1815(17)21(12)10117546811h38H1910H22H3
MFCD00687882
ZINC000000632421
ZINC00632421
ZINC632421
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