Vitas-M small molecule compound
11-(6-chloro-1,3-benzodioxol-5-yl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK003029
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cc(c(c1)C)C)c1cc2OCOc2cc1Cl
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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 C24H25ClN2O3 MW 424.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN2O3/c1-12-5-16-17(6-13(12)2)27-23(14-7-20-21(8-15(14)25)30-11-29-20)22-18(26-16)9-24(3,4)10-19(22)28/h5-8,23,26-27H,9-11H2,1-4H3InChIKey
IOYBVXGEPKKEBH-UHFFFAOYSA-NSynonyms
303203-71-611(6chloro13benzodioxol5yl)3378tetramethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
303203716
6(6chloro13benzodioxol5yl)2399tetramethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=CC5=C(C=C4Cl)OCO5)C(=O)CC(C3)(C)C
InChI=1SC24H25ClN2O3c11251617(613(12)2)2723(1472021(815(14)25)30112920)2218(2616)924(34)1019(22)28h58232627H911H214H3
MFCD01655310
O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cc(c(c1)C)C)c1cc2OCOc2cc1Cl
STK003029
ZINC000000630879
ZINC000000630883
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