Vitas-M small molecule compound
1-(3,5-dimethylphenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-4-oxo-1,4-dihydropyrimidine-2-thiolate
Catalog ID
STL528783
SMILES COc1c2OCOc2cc2c1C([NH+](CC2)C)c1c(=O)nc(n(c1O)c1cc(C)cc(c1)C)[S-]
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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 C24H25N3O5S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O5S/c1-12-7-13(2)9-15(8-12)27-23(29)18(22(28)25-24(27)33)19-17-14(5-6-26(19)3)10-16-20(21(17)30-4)32-11-31-16/h7-10,19,29H,5-6,11H2,1-4H3,(H,25,28,33)InChIKey
MYDLFEGBHZPJQH-UHFFFAOYSA-NSynonyms
1185038-59-81(35dimethylphenyl)6hydroxy5(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin6ium5yl)4oxo14dihydropyrimidine2thiolate
1185038598
3(35dimethylphenyl)5(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin6ium5yl)6oxo2sulfanylidenepyrimidin4olate
4978953
InChI=1SC24H25N3O5Sc112713(2)915(812)2723(29)18(22(28)2524(27)33)191714(5626(19)3)101620(21(17)304)32113116h7101929H5611H214H3(H252833)
MFCD31753899
ZINC000001321564
ZINC000001321565
Check stock
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