Vitas-M small molecule compound
1,3-diethyl-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STL527085
SMILES CCn1c([O-])c(c(=O)n(c1=S)CC)C1OCc2c1c(O)c([nH+]c2)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 C16H19N3O4S MW 349.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O4S/c1-4-18-14(21)11(15(22)19(5-2)16(18)24)13-10-9(7-23-13)6-17-8(3)12(10)20/h6,13,20-21H,4-5,7H2,1-3H3InChIKey
YDXRASFKMYAFMW-UHFFFAOYSA-NSynonyms
1185044-47-61185044476
13DIETHYL5(7HYDROXY6METHYL13DIHYDROFURO(34C)PYRIDIN5IUM1YL)6OXO2SULFANYLIDENEPYRIMIDIN4OLATE
13diethyl5(7hydroxy6methyl13dihydrofuro(34c)pyridin5ium1yl)6oxo2thioxo1236tetrahydropyrimidin4olate
5124212
InChI=1SC16H19N3O4Sc141814(21)11(15(22)19(52)16(18)24)13109(72313)6178(3)12(10)20h6132021H457H213H3
MFCD04144290
ZINC000003999862
ZINC000003999863
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