Vitas-M small molecule compound
8-bromo-1,3-dimethyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL339657
SMILES Cc1nnc(s1)SCCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C
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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 C12H13BrN6O2S2 MW 417.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13BrN6O2S2/c1-6-15-16-11(23-6)22-5-4-19-7-8(14-10(19)13)17(2)12(21)18(3)9(7)20/h4-5H2,1-3H3InChIKey
RLSAVDVMYRSWCF-UHFFFAOYSA-NSynonyms
842974-95-2842974952
8bromo13dimethyl7(2((5methyl134thiadiazol2yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
8BROMO13DIMETHYL7(2((5METHYL134THIADIAZOL2YL)SULFANYL)ETHYL)PURINE26DIONE
8bromo13dimethyl7(2((5methyl134thiadiazol2yl)thio)ethyl)1Hpurine26(3H7H)dione
8BROMO13DIMETHYL7(2(5METHYL(134THIADIAZOL2YLTHIO))ETHYL)137TRIHYDROPURINE26DIONE
CC1=NN=C(S1)SCCN2C3=C(N=C2Br)N(C(=O)N(C3=O)C)C
InChI=1SC12H13BrN6O2S2c16151611(236)22541978(1410(19)13)17(2)12(21)18(3)9(7)20h45H213H3
MFCD04012942
ZINC000002409435
ZINC02409435
ZINC2409435
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