Vitas-M small molecule compound
(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-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
STL523465
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)S(=O)(=O)N1CCN(CC1)C(=O)c1cc(OC)c2c(c1)OCCO2
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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 C26H31N3O9S MW 561.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O9S/c1-27-5-4-17-18(14-27)21(34-3)23-24(38-15-37-23)25(17)39(31,32)29-8-6-28(7-9-29)26(30)16-12-19(33-2)22-20(13-16)35-10-11-36-22/h12-13H,4-11,14-15H2,1-3H3InChIKey
YIQLYAUXNJTRBW-UHFFFAOYSA-NSynonyms
(5methoxy23dihydro14benzodioxin7yl)(4((4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)sulfonyl)piperazin1yl)methanone
(8methoxy23dihydro14benzodioxin6yl)(4((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)sulfonyl)piperazin1yl)methanone
(8methoxy23dihydrobenzo(b)(14)dioxin6yl)(4((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)sulfonyl)piperazin1yl)methanone
125429425
InChI=1SC26H31N3O9Sc127541718(1427)21(343)2324(38153723)25(17)39(3132)298628(7929)26(30)161219(332)2220(1316)3510113622h1213H4111415H213H3
MFCD31752897
ZINC000524730812
ZINC524730812
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