Vitas-M small molecule compound
2-(azepan-1-yl)-N-{4-[(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
STL523398
SMILES COc1c2C=C(N(CCc2c(c2c1OCO2)Br)C)C(=O)c1ccc(cc1)NC(=O)CN1CCCCCC1
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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 C28H32BrN3O5 MW 570.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32BrN3O5/c1-31-14-11-20-21(26(35-2)28-27(24(20)29)36-17-37-28)15-22(31)25(34)18-7-9-19(10-8-18)30-23(33)16-32-12-5-3-4-6-13-32/h7-10,15H,3-6,11-14,16-17H2,1-2H3,(H,30,33)InChIKey
ZCZYQRVFXXWQNG-UHFFFAOYSA-NSynonyms
125428805
2(azepan1yl)~(N)(4(10bromo4methoxy7methyl89dihydro(13)dioxolo(45h)(3)benzazepine6carbonyl)phenyl)acetamide
2(azepan1yl)N(4((4bromo10methoxy7methyl67dihydro5H(13)dioxolo(45h)(3)benzazepin8yl)carbonyl)phenyl)acetamide
2(azepan1yl)N(4(4bromo10methoxy7methyl67dihydro5H(13)dioxolo(4545)benzo(12d)azepine8carbonyl)phenyl)acetamide
InChI=1SC28H32BrN3O5c13114112021(26(352)2827(24(20)29)36173728)1522(31)25(34)187919(10818)3023(33)16321253461332h71015H3611141617H212H3(H3033)
MFCD31752830
ZINC000524730194
ZINC524730194
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