Vitas-M small molecule compound
8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834032
SMILES C/C(=C/CSc1nc2c(n1C)c(=O)[nH]c(=O)n2C)/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 C11H13ClN4O2S MW 300.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13ClN4O2S/c1-6(12)4-5-19-11-13-8-7(15(11)2)9(17)14-10(18)16(8)3/h4H,5H2,1-3H3,(H,14,17,18)/b6-4-InChIKey
ZHEQPDBCCAEDFS-XQRVVYSFSA-NSynonyms
324539-34-6(Z)8((3chlorobut2en1yl)thio)37dimethyl1Hpurine26(3H7H)dione
324539346
8(((2Z)3chlorobut2en1yl)sulfanyl)37dimethyl37dihydro1Hpurine26dione
8((Z)3CHLOROBUT2ENYL)SULFANYL37DIMETHYLPURINE26DIONE
CC(=CCSC1=NC2=C(N1C)C(=O)NC(=O)N2C)Cl
CC(=CCSc1nc2c(n1C)c(=O)(nH)c(=O)n2C)Cl
InChI=1SC11H13ClN4O2Sc16(12)4519111387(15(11)2)9(17)1410(18)16(8)3h4H5H213H3(H141718)b64
MFCD01557186
ZINC000000193537
ZINC00193537
ZINC193537
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