Vitas-M small molecule compound

[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetic acid

Catalog ID
STK661887
SMILES OC(=O)CSc1nc2c(n1C)c(=O)n(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 C10H12N4O4S MW 284.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N4O4S/c1-12-6-7(11-9(12)19-4-5(15)16)13(2)10(18)14(3)8(6)17/h4H2,1-3H3,(H,15,16)
InChIKey
VERREKXUARXHSG-UHFFFAOYSA-N
Synonyms

((137trimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)aceticacid
2((137TRIMETHYL26DIOXO9HPURIN7IUM8YL)SULFANYL)ACETATE
2(137TRIMETHYL26DIOXOPURIN8YL)SULFANYLACETICACID
CN1C2=C(N=C1SCC(=O)O)N(C(=O)N(C2=O)C)C
InChI=1SC10H12N4O4Sc11267(119(12)1945(15)16)13(2)10(18)14(3)8(6)17h4H213H3(H1516)
MFCD01571444
ZINC000169684010
ZINC169684010

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.