Vitas-M small molecule compound
4-methoxy-6-methyl-9-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Catalog ID
STL520098
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)S(=O)(=O)N1CCN(CC1)c1ncccn1
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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 C20H25N5O5S MW 447.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O5S/c1-23-7-4-14-15(12-23)16(28-2)17-18(30-13-29-17)19(14)31(26,27)25-10-8-24(9-11-25)20-21-5-3-6-22-20/h3,5-6H,4,7-13H2,1-2H3InChIKey
PTPXCJOTTWUOCX-UHFFFAOYSA-NSynonyms
1219563-72-01219563720
49652457
4methoxy6methyl9((4(pyrimidin2yl)piperazin1yl)sulfonyl)5678tetrahydro(13)dioxolo(45g)isoquinoline
4methoxy6methyl9(4pyrimidin2ylpiperazin1yl)sulfonyl78dihydro5~(H)(13)dioxolo(45g)isoquinoline
InChI=1SC20H25N5O5Sc123741415(1223)16(282)1718(30132917)19(14)31(2627)2510824(91125)20215362220h356H4713H212H3
MFCD16622579
ZINC000040312476
ZINC40312476
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