Vitas-M small molecule compound
N-(bicyclo[2.2.1]hept-2-yl)-7-chloro-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389725
SMILES O=C(C1CCN(c2c(O1)ccc(c2)Cl)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 C18H23ClN2O4S MW 398.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23ClN2O4S/c1-26(23,24)21-7-6-17(25-16-5-4-13(19)10-15(16)21)18(22)20-14-9-11-2-3-12(14)8-11/h4-5,10-12,14,17H,2-3,6-9H2,1H3,(H,20,22)InChIKey
FIHZKTAGBXEHIW-UHFFFAOYSA-NSynonyms
CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NC3CC4CCC3C4
InChI=1SC18H23ClN2O4Sc126(2324)217617(25165413(19)1015(16)21)18(22)20149112312(14)811h4510121417H2369H21H3(H2022)
MFCD13984870
N(3bicyclo(221)heptanyl)7chloro5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
N(bicyclo(221)hept2yl)7chloro5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
ZINC000106360513
ZINC000245279145
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