Vitas-M small molecule compound
11-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK326249
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1ccc2c(c1)OCO2
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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 C22H22N2O3 MW 362.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O3/c1-22(2)10-16-20(17(25)11-22)21(24-15-6-4-3-5-14(15)23-16)13-7-8-18-19(9-13)27-12-26-18/h3-9,21,23-24H,10-12H2,1-2H3InChIKey
ZQKBFEWLMICUNK-UHFFFAOYSA-NSynonyms
374090-88-711(13benzodioxol5yl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(benzo(d)(13)dioxol5yl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
374090887
6(13benzodioxol5yl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC5=C(C=C4)OCO5)C(=O)C1)C
InChI=1SC22H22N2O3c122(2)101620(17(25)1122)21(2415643514(15)2316)13781819(913)27122618h39212324H1012H212H3
MFCD00813247
ZINC000018190058
ZINC000018190060
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