Vitas-M small molecule compound

1-[11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-chlorophenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-methylpropan-1-one

Catalog ID
STK012014
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cccc2)c1ccc(cc1)Cl

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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 C38H36Cl2N2O4 MW 655.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H36Cl2N2O4/c1-4-45-35-21-26(13-18-34(35)46-22-24-9-14-28(39)15-10-24)37-36-31(19-27(20-33(36)43)25-11-16-29(40)17-12-25)41-30-7-5-6-8-32(30)42(37)38(44)23(2)3/h5-18,21,23,27,37,43H,4,19-20,22H2,1-3H3
InChIKey
LKQSJBOWWGXSDG-UHFFFAOYSA-N
Synonyms

1(11(4((4chlorobenzyl)oxy)3ethoxyphenyl)3(4chlorophenyl)1hydroxy23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2methylpropan1one
CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cccc2)c1ccc(cc1)Cl
MFCD03372657
STK012014
ZINC000150398785
ZINC000150398794

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Available files

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