Vitas-M small molecule compound

3-methyl-7-(3-methylbutyl)-8-[(2-oxopropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK834696
SMILES CC(CCn1c(SCC(=O)C)nc2c1c(=O)[nH]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 C14H20N4O3S MW 324.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N4O3S/c1-8(2)5-6-18-10-11(15-14(18)22-7-9(3)19)17(4)13(21)16-12(10)20/h8H,5-7H2,1-4H3,(H,16,20,21)
InChIKey
SYWAZNGPIPXHKL-UHFFFAOYSA-N
Synonyms
330818-35-4
330818354
3methyl7(3methylbutyl)8((2oxopropyl)sulfanyl)37dihydro1Hpurine26dione
3METHYL7(3METHYLBUTYL)8(2OXOPROPYLSULFANYL)PURINE26DIONE
3METHYL7(3METHYLBUTYL)8(2OXOPROPYLTHIO)137TRIHYDROPURINE26DIONE
7ISOPENTYL3METHYL8((2OXOPROPYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7ISOPENTYL3METHYL8((2OXOPROPYL)THIO)1HPURINE26(3H7H)DIONE
CC(C)CCN1C2=C(N=C1SCC(=O)C)N(C(=O)NC2=O)C
CC(CCn1c(SCC(=O)C)nc2c1c(=O)(nH)c(=O)n2C)C
InChI=1SC14H20N4O3Sc18(2)56181011(1514(18)2279(3)19)17(4)13(21)1612(10)20h8H57H214H3(H162021)
MFCD00653134
ZINC000000342470
ZINC00342470
ZINC342470

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Available files

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