Vitas-M small molecule compound
N-{4-[(4-bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)carbonyl]phenyl}-3-methylbutanamide
Catalog ID
STL523619
SMILES COc1c2C=C(N(CCc2c(c2c1OCO2)Br)C)C(=O)c1ccc(cc1)NC(=O)CC(C)C
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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 C25H27BrN2O5 MW 515.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27BrN2O5/c1-14(2)11-20(29)27-16-7-5-15(6-8-16)22(30)19-12-18-17(9-10-28(19)3)21(26)24-25(23(18)31-4)33-13-32-24/h5-8,12,14H,9-11,13H2,1-4H3,(H,27,29)InChIKey
IPWLRTVMZLMYTK-UHFFFAOYSA-NSynonyms
~(N)(4(10bromo4methoxy7methyl89dihydro(13)dioxolo(45h)(3)benzazepine6carbonyl)phenyl)3methylbutanamide
125428368
InChI=1SC25H27BrN2O5c114(2)1120(29)27167515(6816)22(30)19121817(91028(19)3)21(26)2425(23(18)314)33133224h581214H91113H214H3(H2729)
MFCD31753050
N(4((4bromo10methoxy7methyl67dihydro5H(13)dioxolo(45h)(3)benzazepin8yl)carbonyl)phenyl)3methylbutanamide
N(4(4bromo10methoxy7methyl67dihydro5H(13)dioxolo(4545)benzo(12d)azepine8carbonyl)phenyl)3methylbutanamide
ZINC000524729757
ZINC524729757
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