Vitas-M small molecule compound
(5-bromopyridin-3-yl){4-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)sulfonyl]piperazin-1-yl}methanone
Catalog ID
STL523929
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)S(=O)(=O)N1CCN(CC1)C(=O)c1cncc(c1)Br
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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 C22H25BrN4O6S MW 553.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN4O6S/c1-25-4-3-16-17(12-25)18(31-2)19-20(33-13-32-19)21(16)34(29,30)27-7-5-26(6-8-27)22(28)14-9-15(23)11-24-10-14/h9-11H,3-8,12-13H2,1-2H3InChIKey
QYCQJGUCKOAIOA-UHFFFAOYSA-NSynonyms
(5bromopyridin3yl)(4((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)sulfonyl)piperazin1yl)methanone
(5bromopyridin3yl)(4((4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)sulfonyl)piperazin1yl)methanone
125428614
InChI=1SC22H25BrN4O6Sc125431617(1225)18(312)1920(33133219)21(16)34(2930)277526(6827)22(28)14915(23)11241014h911H381213H212H3
MFCD31753357
ZINC000524730003
ZINC524730003
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