Vitas-M small molecule compound
(4-methylpiperidin-1-yl)[5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-2-yl]methanone
Catalog ID
STL389694
SMILES CC1CCN(CC1)C(=O)C1CCN(c2c(O1)cccc2)S(=O)(=O)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 C17H24N2O4S MW 352.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24N2O4S/c1-13-7-10-18(11-8-13)17(20)16-9-12-19(24(2,21)22)14-5-3-4-6-15(14)23-16/h3-6,13,16H,7-12H2,1-2H3InChIKey
YADGBNNKYNIOBN-UHFFFAOYSA-NSynonyms
(4methylpiperidin1yl)(5(methylsulfonyl)2345tetrahydro15benzoxazepin2yl)methanone
(4methylpiperidin1yl)(5methylsulfonyl34dihydro2H15benzoxazepin2yl)methanone
CC1CCN(CC1)C(=O)C2CCN(C3=CC=CC=C3O2)S(=O)(=O)C
InChI=1SC17H24N2O4Sc11371018(11813)17(20)1691219(24(221)22)14534615(14)2316h361316H712H212H3
MFCD13984013
ZINC000038835727
ZINC000038835730
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