Vitas-M small molecule compound
6-hydroxy-3-methyl-7-(prop-2-en-1-yl)-8-(pyrimidin-2-ylsulfanyl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK567461
SMILES C=CCn1c(Sc2ncccn2)nc2c1c(O)nc(=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 C13H12N6O2S MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N6O2S/c1-3-7-19-8-9(18(2)12(21)17-10(8)20)16-13(19)22-11-14-5-4-6-15-11/h3-6H,1,7H2,2H3,(H,17,20,21)InChIKey
YLYBEMZGGIMSEH-UHFFFAOYSA-NSynonyms
714924-19-33METHYL7PROP2ENYL8PYRIMIDIN2YLSULFANYLPURINE26DIONE
6hydroxy3methyl7(prop2en1yl)8(pyrimidin2ylsulfanyl)37dihydro2Hpurin2one
7ALLYL3METHYL8(PYRIMIDIN2YLSULFANYL)37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SC3=NC=CC=N3)CC=C
InChI=1SC13H12N6O2Sc1371989(18(2)12(21)1710(8)20)1613(19)2211145461511h36H17H22H3(H172021)
MFCD05733597
ZINC000000543715
ZINC00543715
ZINC543715
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Check stock on Vitas-MAvailable files
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