Vitas-M small molecule compound
methyl [(7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Catalog ID
STK762363
SMILES COC(=O)CSc1nc2c(n1CC)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 C12H16N4O4S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O4S/c1-5-16-8-9(13-11(16)21-6-7(17)20-4)14(2)12(19)15(3)10(8)18/h5-6H2,1-4H3InChIKey
YLROFJFQYJTOLS-UHFFFAOYSA-NSynonyms
299920-29-9299920299
CCN1C2=C(N=C1SCC(=O)OC)N(C(=O)N(C2=O)C)C
InChI=1SC12H16N4O4Sc151689(1311(16)2167(17)204)14(2)12(19)15(3)10(8)18h56H214H3
methyl((7ethyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
METHYL2(7ETHYL13DIMETHYL26DIOXOPURIN8YL)SULFANYLACETATE
MFCD01872890
ZINC000000084265
ZINC00084265
ZINC84265
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