Vitas-M small molecule compound
6-hydroxy-5-{[4-hydroxy-6-oxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5-yl](pyridin-2-yl)methyl}-1-(prop-2-en-1-yl)-2-sulfanylpyrimidin-4(1H)-one
Catalog ID
STL339473
SMILES C=CCn1c(S)nc(=O)c(c1O)C(c1c(O)nc(n(c1=O)CC=C)S)c1ccccn1
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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 C20H19N5O4S2 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O4S2/c1-3-9-24-17(28)13(15(26)22-19(24)30)12(11-7-5-6-8-21-11)14-16(27)23-20(31)25(10-4-2)18(14)29/h3-8,12,26,29H,1-2,9-10H2,(H,22,30)(H,23,27,31)InChIKey
CLDJBIFCGANEHH-UHFFFAOYSA-NSynonyms
1allyl5((1allyl4hydroxy2mercapto6oxo16dihydropyrimidin5yl)(pyridin2yl)methyl)6hydroxy2mercaptopyrimidin4(1H)one
6hydroxy5((4hydroxy6oxo1(prop2en1yl)2sulfanyl16dihydropyrimidin5yl)(pyridin2yl)methyl)1(prop2en1yl)2sulfanylpyrimidin4(1H)one
MFCD04011639
ZINC000018179240
ZINC000101038120
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