Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yloxy)-N-{3-[(4-bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)carbonyl]phenyl}acetamide
Catalog ID
STL523098
SMILES COc1c2C=C(N(CCc2c(c2c1OCO2)Br)C)C(=O)c1cccc(c1)NC(=O)COc1ccc2c(c1)OCO2
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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 C29H25BrN2O8 MW 609.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrN2O8/c1-32-9-8-19-20(27(35-2)29-28(25(19)30)39-15-40-29)12-21(32)26(34)16-4-3-5-17(10-16)31-24(33)13-36-18-6-7-22-23(11-18)38-14-37-22/h3-7,10-12H,8-9,13-15H2,1-2H3,(H,31,33)InChIKey
SOAFXCLNOPYKCQ-UHFFFAOYSA-NSynonyms
121541950
2(13benzodioxol5yloxy)~(N)(3(10bromo4methoxy7methyl89dihydro(13)dioxolo(45h)(3)benzazepine6carbonyl)phenyl)acetamide
2(13benzodioxol5yloxy)N(3((4bromo10methoxy7methyl67dihydro5H(13)dioxolo(45h)(3)benzazepin8yl)carbonyl)phenyl)acetamide
2(benzo(d)(13)dioxol5yloxy)N(3(4bromo10methoxy7methyl67dihydro5H(13)dioxolo(4545)benzo(12d)azepine8carbonyl)phenyl)acetamide
InChI=1SC29H25BrN2O8c132981920(27(352)2928(25(19)30)39154029)1221(32)26(34)1643517(1016)3124(33)133618672223(1118)38143722h371012H891315H212H3(H3133)
MFCD30344465
ZINC000263586316
ZINC263586316
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