Vitas-M small molecule compound

6-hydroxy-3-methyl-7-(3-methylbutyl)-8-thioxo-3,7,8,9-tetrahydro-2H-purin-2-one

Catalog ID
STL046043
SMILES CC(CCn1c(=S)[nH]c2c1c(O)nc(=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 C11H16N4O2S MW 268.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H16N4O2S/c1-6(2)4-5-15-7-8(12-11(15)18)14(3)10(17)13-9(7)16/h6H,4-5H2,1-3H3,(H,12,18)(H,13,16,17)
InChIKey
AVEOPOLAQTXBAI-UHFFFAOYSA-N
Synonyms
126118-61-4
126118614
3METHYL7(3METHYLBUTYL)8SULFANYL137TRIHYDROPURINE26DIONE
3METHYL7(3METHYLBUTYL)8SULFANYLIDENE9HPURINE26DIONE
6hydroxy3methyl7(3methylbutyl)8thioxo3789tetrahydro2Hpurin2one
7ISOPENTYL8MERCAPTO3METHYL1HPURINE26(3H7H)DIONE
CC(C)CCN1C2=C(NC1=S)N(C(=O)NC2=O)C
CC(CCn1c(=S)(nH)c2c1c(O)nc(=O)n2C)C
InChI=1SC11H16N4O2Sc16(2)451578(1211(15)18)14(3)10(17)139(7)16h6H45H213H3(H1218)(H131617)
MFCD04074862
ZINC000100297940
ZINC100297940

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Available files

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