Vitas-M small molecule compound

8-(butan-2-ylsulfanyl)-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK093727
SMILES CCCn1c(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 C13H20N4O2S MW 296.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N4O2S/c1-5-7-17-9-10(14-13(17)20-8(3)6-2)16(4)12(19)15-11(9)18/h8H,5-7H2,1-4H3,(H,15,18,19)
InChIKey
TXCIKCNULGCBFA-UHFFFAOYSA-N
Synonyms
316361-77-0
316361770
3METHYL8(METHYLPROPYLTHIO)7PROPYL137TRIHYDROPURINE26DIONE
8(BUTAN2YLSULFANYL)3METHYL7PROPYL37DIHYDRO1HPURINE26DIONE
8(SECBUTYLTHIO)3METHYL7PROPYL1HPURINE26(3H7H)DIONE
8BUTAN2YLSULFANYL3METHYL7PROPYLPURINE26DIONE
8SECBUTYLSULFANYL3METHYL7PROPYL37DIHYDROPURINE26DIONE
CCCn1c(SC(CC)C)nc2c1c(=O)(nH)c(=O)n2C
CCCN1C2=C(N=C1SC(C)CC)N(C(=O)NC2=O)C
InChI=1SC13H20N4O2Sc15717910(1413(17)208(3)62)16(4)12(19)1511(9)18h8H57H214H3(H151819)
MFCD01079328
STK093727
ZINC000000180700
ZINC000000180702

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Available files

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