Vitas-M small molecule compound
8-[(2E)-but-2-en-1-ylsulfanyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK031588
SMILES CCCn1c(SC/C=C/C)nc2c1c(=O)[nH]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 C13H18N4O2S MW 294.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O2S/c1-4-6-8-20-13-14-10-9(17(13)7-5-2)11(18)15-12(19)16(10)3/h4,6H,5,7-8H2,1-3H3,(H,15,18,19)/b6-4+InChIKey
MTTKZGROJFYNOM-GQCTYLIASA-NSynonyms
1164480-59-4(E)8(but2en1ylthio)3methyl7propyl1Hpurine26(3H7H)dione
1164480594
8(((E)BUT2ENYL)SULFANYL)3METHYL7PROPYL37DIHYDROPURINE26DIONE
8((2E)BUT2EN1YLSULFANYL)3METHYL7PROPYL37DIHYDRO1HPURINE26DIONE
8((2E)BUT2ENYLTHIO)3METHYL7PROPYL137TRIHYDROPURINE26DIONE
8((E)BUT2ENYL)SULFANYL3METHYL7PROPYLPURINE26DIONE
8BUT2ENYLSULFANYL3METHYL7PROPYL37DIHYDROPURINE26DIONE
CCCn1c(SCC=CC)nc2c1c(=O)(nH)c(=O)n2C
CCCN1C2=C(N=C1SCC=CC)N(C(=O)NC2=O)C
InChI=1SC13H18N4O2Sc1468201314109(17(13)752)11(18)1512(19)16(10)3h46H578H213H3(H151819)b64+
MFCD01555368
STK031588
ZINC000013124200
ZINC13124200
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