Vitas-M small molecule compound

1-[1-hydroxy-3,3-dimethyl-11-(3,4,5-trimethoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-phenylethanone

Catalog ID
STL528273
SMILES COc1c(OC)cc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)Cc1ccccc1)cccc2)(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 C32H34N2O5 MW 526.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O5/c1-32(2)18-23-29(25(35)19-32)30(21-16-26(37-3)31(39-5)27(17-21)38-4)34(24-14-10-9-13-22(24)33-23)28(36)15-20-11-7-6-8-12-20/h6-14,16-17,30,35H,15,18-19H2,1-5H3
InChIKey
IYMYGDQCFXSFHB-UHFFFAOYSA-N
Synonyms

1(1hydroxy33dimethyl11(345trimethoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2phenylethanone
InChI=1SC32H34N2O5c132(2)182329(25(35)1932)30(211626(373)31(395)27(1721)384)34(24141091322(24)3323)28(36)1520117681220h61416173035H151819H215H3
MFCD03811095
ZINC000103899688
ZINC000103899694

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Available files

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