Vitas-M small molecule compound
1,8-dibromo-17-(2,5-dimethoxyphenyl)-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
STK674062
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C1(Br)c3c(C2(Br)c2c1cccc2)cccc3)OC
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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 C26H19Br2NO4 MW 569.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19Br2NO4/c1-32-14-11-12-20(33-2)19(13-14)29-23(30)21-22(24(29)31)26(28)16-8-4-3-7-15(16)25(21,27)17-9-5-6-10-18(17)26/h3-13,21-22H,1-2H3InChIKey
DPFXYEMVDGFXLK-UHFFFAOYSA-NSynonyms
18dibromo17(25dimethoxyphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
COC1=CC(=C(C=C1)OC)N2C(=O)C3C(C2=O)C4(C5=CC=CC=C5C3(C6=CC=CC=C64)Br)Br
InChI=1SC26H19Br2NO4c13214111220(332)19(1314)2923(30)2122(24(29)31)26(28)16843715(16)25(2127)179561018(17)26h3132122H12H3
MFCD01187883
ZINC000003664937
ZINC000003664940
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