Vitas-M small molecule compound
N-{3-[(4-bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)carbonyl]phenyl}-9-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL523182
SMILES COc1cc(cc2c1OCCCO2)C(=O)Nc1cccc(c1)C(=O)C1=Cc2c(CCN1C)c(Br)c1c(c2OC)OCO1
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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 C31H29BrN2O8 MW 637.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29BrN2O8/c1-34-9-8-20-21(27(38-3)30-29(25(20)32)41-16-42-30)15-22(34)26(35)17-6-4-7-19(12-17)33-31(36)18-13-23(37-2)28-24(14-18)39-10-5-11-40-28/h4,6-7,12-15H,5,8-11,16H2,1-3H3,(H,33,36)InChIKey
RVXBYJUXDRZPDQ-UHFFFAOYSA-NSynonyms
~(N)(3(10bromo4methoxy7methyl89dihydro(13)dioxolo(45h)(3)benzazepine6carbonyl)phenyl)6methoxy34dihydro2~(H)15benzodioxepine8carboxamide
121542296
InChI=1SC31H29BrN2O8c134982021(27(383)3029(25(20)32)41164230)1522(34)26(35)1764719(1217)3331(36)181323(372)2824(1418)39105114028h4671215H581116H213H3(H3336)
MFCD30344658
N(3((4bromo10methoxy7methyl67dihydro5H(13)dioxolo(45h)(3)benzazepin8yl)carbonyl)phenyl)9methoxy34dihydro2H15benzodioxepine7carboxamide
N(3(4bromo10methoxy7methyl67dihydro5H(13)dioxolo(4545)benzo(12d)azepine8carbonyl)phenyl)9methoxy34dihydro2Hbenzo(b)(14)dioxepine7carboxamide
ZINC000263586263
ZINC263586263
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