Vitas-M small molecule compound

6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-8-(propan-2-ylsulfanyl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK586778
SMILES CC(=C)Cn1c(SC(C)C)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 C13H18N4O2S MW 294.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O2S/c1-7(2)6-17-9-10(14-13(17)20-8(3)4)16(5)12(19)15-11(9)18/h8H,1,6H2,2-5H3,(H,15,18,19)
InChIKey
IYWVQLAIGYAKAT-UHFFFAOYSA-N
Synonyms
332098-53-0
332098530
3METHYL7(2METHYLPROP2ENYL)8PROPAN2YLSULFANYLPURINE26DIONE
3METHYL8(METHYLETHYLTHIO)7(2METHYLPROP2ENYL)137TRIHYDROPURINE26DIONE
6hydroxy3methyl7(2methylprop2en1yl)8(propan2ylsulfanyl)37dihydro2Hpurin2one
8(ISOPROPYLSULFANYL)3METHYL7(2METHYL2PROPENYL)37DIHYDRO1HPURINE26DIONE
8ISOPROPYLSULFANYL3METHYL7(2METHYLALLYL)37DIHYDROPURINE26DIONE
CC(C)SC1=NC2=C(N1CC(=C)C)C(=O)NC(=O)N2C
InChI=1SC13H18N4O2Sc17(2)617910(1413(17)208(3)4)16(5)12(19)1511(9)18h8H16H225H3(H151819)
MFCD07208945
ZINC000000266797
ZINC00266797
ZINC266797

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Available files

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