Vitas-M small molecule compound
3-(2-chlorophenyl)-11-(2-ethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403296
SMILES CCOc1ccccc1C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1Cl
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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 C27H25ClN2O2 MW 444.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN2O2/c1-2-32-25-14-8-4-10-19(25)27-26-23(29-21-12-6-7-13-22(21)30-27)15-17(16-24(26)31)18-9-3-5-11-20(18)28/h3-14,17,27,29-30H,2,15-16H2,1H3InChIKey
NVTWIXACOHQGCP-UHFFFAOYSA-NSynonyms
3(2chlorophenyl)11(2ethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(2chlorophenyl)6(2ethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC=CC=C4Cl)NC5=CC=CC=C5N2
InChI=1SC27H25ClN2O2c12322514841019(25)272623(292112671322(21)3027)1517(1624(26)31)189351120(18)28h31417272930H21516H21H3
MFCD03307919
ZINC000008846662
ZINC000008846665
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