Vitas-M small molecule compound
8-(butan-2-ylsulfanyl)-7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL323696
SMILES CCC(Sc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C)C
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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 C14H19ClN4O2S MW 342.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19ClN4O2S/c1-5-9(3)22-14-16-11-10(19(14)7-6-8(2)15)12(20)17-13(21)18(11)4/h6,9H,5,7H2,1-4H3,(H,17,20,21)/b8-6-InChIKey
QKLMSORCCIQRBI-VURMDHGXSA-NSynonyms
331726-04-6(Z)8(secbutylthio)7(3chlorobut2en1yl)3methyl1Hpurine26(3H7H)dione
331726046
7((2Z)3CHLOROBUT2ENYL)3METHYL8(METHYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
8(butan2ylsulfanyl)7((2Z)3chlorobut2en1yl)3methyl37dihydro1Hpurine26dione
8BUTAN2YLSULFANYL7((Z)3CHLOROBUT2ENYL)3METHYLPURINE26DIONE
CCC(C)SC1=NC2=C(N1CC=C(C)Cl)C(=O)NC(=O)N2C
CCC(Sc1nc2c(n1CC=C(Cl)C)c(=O)(nH)c(=O)n2C)C
InChI=1SC14H19ClN4O2Sc159(3)2214161110(19(14)768(2)15)12(20)1713(21)18(11)4h69H57H214H3(H172021)b86
MFCD00981699
ZINC000000228735
ZINC000000228744
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