Vitas-M small molecule compound
4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Catalog ID
STK610450
SMILES O=C(c1ccc2c(c1)OCCO2)CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)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 C22H21NO6 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6/c1-13(2)20-22(26)23(21(25)15-5-3-4-6-17(15)29-20)12-16(24)14-7-8-18-19(11-14)28-10-9-27-18/h3-8,11,13,20H,9-10,12H2,1-2H3InChIKey
PEJXTNSZQSNIAU-UHFFFAOYSA-NSynonyms
904500-80-74(2(23dihydro14benzodioxin6yl)2oxoethyl)2(propan2yl)14benzoxazepine35(2H4H)dione
4(2(23dihydro14benzodioxin6yl)2oxoethyl)2propan2yl14benzoxazepine35dione
4(2(23dihydrobenzo(b)(14)dioxin6yl)2oxoethyl)2isopropylbenzo(f)(14)oxazepine35(2H4H)dione
4(2(2H3HBENZO(34E)14DIOXIN6YL)2OXOETHYL)2(METHYLETHYL)2HBENZO(F)14OXAZAPERHYDROEPINE35DIONE
904500807
CC(C)C1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC4=C(C=C3)OCCO4
InChI=1SC22H21NO6c113(2)2022(26)23(21(25)15534617(15)2920)1216(24)14781819(1114)281092718h38111320H91012H212H3
MFCD08284909
ZINC000006661297
ZINC000006661299
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