Vitas-M small molecule compound
7-chloro-N-ethyl-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389552
SMILES CCNC(=O)C1CCN(c2c(O1)ccc(c2)Cl)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 C13H17ClN2O4S MW 332.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17ClN2O4S/c1-3-15-13(17)12-6-7-16(21(2,18)19)10-8-9(14)4-5-11(10)20-12/h4-5,8,12H,3,6-7H2,1-2H3,(H,15,17)InChIKey
NULGPQVDCVVVRV-UHFFFAOYSA-NSynonyms
7chloroNethyl5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
7chloroNethyl5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
CCNC(=O)C1CCN(C2=C(O1)C=CC(=C2)Cl)S(=O)(=O)C
InChI=1SC13H17ClN2O4Sc131513(17)126716(21(218)19)1089(14)4511(10)2012h45812H367H212H3(H1517)
MFCD13981938
ZINC000038832177
ZINC000038832178
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