Vitas-M small molecule compound
[7-methyl-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-2-yl](pyrrolidin-1-yl)methanone
Catalog ID
STL386115
SMILES Cc1ccc2c(c1)N(CCC(O2)C(=O)N1CCCC1)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 C16H22N2O4S MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O4S/c1-12-5-6-14-13(11-12)18(23(2,20)21)10-7-15(22-14)16(19)17-8-3-4-9-17/h5-6,11,15H,3-4,7-10H2,1-2H3InChIKey
ZLPVAEWIYCASMU-UHFFFAOYSA-NSynonyms
(7methyl5(methylsulfonyl)2345tetrahydro15benzoxazepin2yl)(pyrrolidin1yl)methanone
(7methyl5methylsulfonyl34dihydro2H15benzoxazepin2yl)pyrrolidin1ylmethanone
CC1=CC2=C(C=C1)OC(CCN2S(=O)(=O)C)C(=O)N3CCCC3
InChI=1SC16H22N2O4Sc112561413(1112)18(23(220)21)10715(2214)16(19)17834917h561115H34710H212H3
MFCD27225229
ZINC000064988370
ZINC000064988372
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