Vitas-M small molecule compound
3-bromo-N-[1-(octahydro-1H-2,5-methanoinden-4-yl)ethyl]-2-oxo-2H-pyran-5-carboxamide
Catalog ID
STL241166
SMILES CC(C1C2CCC3C1CC(C2)C3)NC(=O)c1coc(=O)c(c1)Br
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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 C18H22BrNO3 MW 380.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22BrNO3/c1-9(20-17(21)13-7-15(19)18(22)23-8-13)16-12-3-2-11-4-10(5-12)6-14(11)16/h7-12,14,16H,2-6H2,1H3,(H,20,21)InChIKey
PGLXEDMYMQAPFM-UHFFFAOYSA-NSynonyms
1212383-38-41212383384
3BROMON((1S)1((2S3AR4R5R7AS)OCTAHYDRO1H25METHANOINDEN4YL)ETHYL)2OXO2HPYRAN5CARBOXAMIDE
3bromoN(1(octahydro1H25methanoinden4yl)ethyl)2oxo2Hpyran5carboxamide
CC(C1C2CCC3C1CC(C3)C2)NC(=O)C4=COC(=O)C(=C4)Br
InChI=1SC18H22BrNO3c19(2017(21)13715(19)18(22)23813)16123211410(512)614(11)16h7121416H26H21H3(H2021)
MFCD05680930
ZINC000252383369
ZINC000252383372
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