Vitas-M small molecule compound
8-[(2,3-dihydroxypropyl)sulfanyl]-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL059006
SMILES OCC(CSc1nc2c(n1CC(=C)C)c(=O)[nH]c(=O)n2C)O
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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 C13H18N4O4S MW 326.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O4S/c1-7(2)4-17-9-10(16(3)12(21)15-11(9)20)14-13(17)22-6-8(19)5-18/h8,18-19H,1,4-6H2,2-3H3,(H,15,20,21)InChIKey
OLVTZKXZXKCQGX-UHFFFAOYSA-NSynonyms
332098-84-7332098847
8((23dihydroxypropyl)sulfanyl)3methyl7(2methylprop2en1yl)37dihydro1Hpurine26dione
8((23DIHYDROXYPROPYL)THIO)3METHYL7(2METHYLALLYL)1HPURINE26(3H7H)DIONE
8(23DIHYDROXYPROPYLSULFANYL)3METHYL7(2METHYLPROP2ENYL)PURINE26DIONE
CC(=C)CN1C2=C(N=C1SCC(CO)O)N(C(=O)NC2=O)C
InChI=1SC13H18N4O4Sc17(2)417910(16(3)12(21)1511(9)20)1413(17)2268(19)518h81819H146H223H3(H152021)
MFCD01875973
OCC(CSc1nc2c(n1CC(=C)C)c(=O)(nH)c(=O)n2C)O
ZINC000000407674
ZINC000000407675
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