Vitas-M small molecule compound
1-{(E)-[(3-bromophenyl)imino]methyl}-17-(4-methoxyphenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STK663418
SMILES COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(/C=N/c3cccc(c3)Br)c3c(C2c2c1cccc2)cccc3
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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 C32H23BrN2O3 MW 563.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23BrN2O3/c1-38-22-15-13-21(14-16-22)35-30(36)28-27-23-9-2-4-11-25(23)32(29(28)31(35)37,26-12-5-3-10-24(26)27)18-34-20-8-6-7-19(33)17-20/h2-18,27-29H,1H3/b34-18+InChIKey
QNNKLGKXXUDCHC-FABQOPTDSA-NSynonyms
1((E)((3bromophenyl)imino)methyl)17(4methoxyphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(C=Nc3cccc(c3)Br)c3c(C2c2c1cccc2)cccc3
MFCD01204868
ZINC000008406882
ZINC000008406894
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