Vitas-M small molecule compound
8-(butan-2-ylsulfanyl)-7-[(2E)-but-2-en-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834131
SMILES C/C=C/Cn1c(SC(CC)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 C14H20N4O2S MW 308.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N4O2S/c1-5-7-8-18-10-11(15-14(18)21-9(3)6-2)17(4)13(20)16-12(10)19/h5,7,9H,6,8H2,1-4H3,(H,16,19,20)/b7-5+InChIKey
AELMSCHSHQMFKP-FNORWQNLSA-NSynonyms
329699-77-6(E)7(but2en1yl)8(secbutylthio)3methyl1Hpurine26(3H7H)dione
329699776
7((2E)BUT2ENYL)3METHYL8(METHYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
8(butan2ylsulfanyl)7((2E)but2en1yl)3methyl37dihydro1Hpurine26dione
8BUTAN2YLSULFANYL7((E)BUT2ENYL)3METHYLPURINE26DIONE
CC=CCn1c(SC(CC)C)nc2c1c(=O)(nH)c(=O)n2C
CCC(C)SC1=NC2=C(N1CC=CC)C(=O)NC(=O)N2C
InChI=1SC14H20N4O2Sc1578181011(1514(18)219(3)62)17(4)13(20)1612(10)19h579H68H214H3(H161920)b75+
MFCD01554325
ZINC000013512437
ZINC000013512441
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