Vitas-M small molecule compound

1,3-dimethyl-7-(prop-2-en-1-yl)-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL070760
SMILES C=CCn1c(SCCC)nc2c1c(=O)n(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 C13H18N4O2S MW 294.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O2S/c1-5-7-17-9-10(14-12(17)20-8-6-2)15(3)13(19)16(4)11(9)18/h5H,1,6-8H2,2-4H3
InChIKey
PGDLZOMMARIAMQ-UHFFFAOYSA-N
Synonyms
377063-48-4
13dimethyl7(prop2en1yl)8(propylsulfanyl)37dihydro1Hpurine26dione
13DIMETHYL7PROP2ENYL8PROPYLSULFANYLPURINE26DIONE
13DIMETHYL7PROP2ENYL8PROPYLTHIO137TRIHYDROPURINE26DIONE
377063484
7ALLYL13DIMETHYL8(PROPYLSULFANYL)37DIHYDRO1HPURINE26DIONE
7allyl13dimethyl8(propylthio)1Hpurine26(3H7H)dione
7ALLYL13DIMETHYL8PROPYLSULFANYL37DIHYDROPURINE26DIONE
CCCSC1=NC2=C(N1CC=C)C(=O)N(C(=O)N2C)C
InChI=1SC13H18N4O2Sc15717910(1412(17)20862)15(3)13(19)16(4)11(9)18h5H168H224H3
MFCD02227428
ZINC000002072307
ZINC02072307
ZINC2072307

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Available files

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