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}-8-methoxy-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STL523052
SMILES COc1cc(cc2c1OCCO2)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 C30H27BrN2O8 MW 623.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27BrN2O8/c1-33-8-7-19-20(26(37-3)29-28(24(19)31)40-15-41-29)14-21(33)25(34)16-5-4-6-18(11-16)32-30(35)17-12-22(36-2)27-23(13-17)38-9-10-39-27/h4-6,11-14H,7-10,15H2,1-3H3,(H,32,35)InChIKey
NGXULYFQNVJJAR-UHFFFAOYSA-NSynonyms
~(N)(3(10bromo4methoxy7methyl89dihydro(13)dioxolo(45h)(3)benzazepine6carbonyl)phenyl)5methoxy23dihydro14benzodioxine7carboxamide
121541283
InChI=1SC30H27BrN2O8c133871920(26(373)2928(24(19)31)40154129)1421(33)25(34)1654618(1116)3230(35)171222(362)2723(1317)389103927h461114H71015H213H3(H3235)
MFCD30344119
N(3((4bromo10methoxy7methyl67dihydro5H(13)dioxolo(45h)(3)benzazepin8yl)carbonyl)phenyl)8methoxy23dihydro14benzodioxine6carboxamide
N(3(4bromo10methoxy7methyl67dihydro5H(13)dioxolo(4545)benzo(12d)azepine8carbonyl)phenyl)8methoxy23dihydrobenzo(b)(14)dioxine6carboxamide
ZINC000263585858
ZINC263585858
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