Vitas-M small molecule compound

N-(bicyclo[2.2.1]hept-2-yl)-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide

Catalog ID
STL389724
SMILES O=C(C1CCN(c2c(O1)cccc2)S(=O)(=O)C)NC1CC2CC1CC2

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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 C18H24N2O4S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O4S/c1-25(22,23)20-9-8-17(24-16-5-3-2-4-15(16)20)18(21)19-14-11-12-6-7-13(14)10-12/h2-5,12-14,17H,6-11H2,1H3,(H,19,21)
InChIKey
MPDGJZRAXONSBA-UHFFFAOYSA-N
Synonyms

CS(=O)(=O)N1CCC(OC2=CC=CC=C21)C(=O)NC3CC4CCC3C4
InChI=1SC18H24N2O4Sc125(2223)209817(2416532415(16)20)18(21)191411126713(14)1012h25121417H611H21H3(H1921)
MFCD13984869
N(3bicyclo(221)heptanyl)5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
N(bicyclo(221)hept2yl)5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
ZINC000106360026
ZINC000245280035

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.