Vitas-M small molecule compound
11-(4-ethoxyphenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK066035
SMILES CCOc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1
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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 C27H26N2O2 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O2/c1-2-31-21-14-12-19(13-15-21)27-26-24(28-22-10-6-7-11-23(22)29-27)16-20(17-25(26)30)18-8-4-3-5-9-18/h3-15,20,27-29H,2,16-17H2,1H3InChIKey
LWCLVCXZIGQUJM-UHFFFAOYSA-NSynonyms
11(4ethoxyphenyl)3phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4ethoxyphenyl)9phenyl56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=CC=CC=C5N2
CCOc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1
InChI=1SC27H26N2O2c123121141219(131521)272624(282210671123(22)2927)1620(1725(26)30)188435918h315202729H21617H21H3
MFCD02068221
STK066035
ZINC000000812934
ZINC000000812937
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