Vitas-M small molecule compound

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

Catalog ID
STK834894
SMILES COCCn1c(SCC(=O)C)nc2c1c(=O)[nH]c(=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 C12H16N4O4S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O4S/c1-7(17)6-21-12-13-9-8(16(12)4-5-20-3)10(18)14-11(19)15(9)2/h4-6H2,1-3H3,(H,14,18,19)
InChIKey
WMPQRQIYIOLNEY-UHFFFAOYSA-N
Synonyms
333768-94-8
333768948
7(2methoxyethyl)3methyl8((2oxopropyl)sulfanyl)37dihydro1Hpurine26dione
7(2METHOXYETHYL)3METHYL8((2OXOPROPYL)THIO)1HPURINE26(3H7H)DIONE
7(2METHOXYETHYL)3METHYL8(2OXOPROPYLSULFANYL)PURINE26DIONE
7(2METHOXYETHYL)3METHYL8(2OXOPROPYLTHIO)137TRIHYDROPURINE26DIONE
CC(=O)CSC1=NC2=C(N1CCOC)C(=O)NC(=O)N2C
COCCn1c(SCC(=O)C)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC12H16N4O4Sc17(17)621121398(16(12)45203)10(18)1411(19)15(9)2h46H213H3(H141819)
MFCD01815905
ZINC000012379312
ZINC12379312

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Available files

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