Vitas-M small molecule compound
1,8-dibromo-17-(prop-2-en-1-yl)-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
STK710003
SMILES C=CCN1C(=O)C2C(C1=O)C1(Br)c3c(C2(Br)c2c1cccc2)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 C21H15Br2NO2 MW 473.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Br2NO2/c1-2-11-24-18(25)16-17(19(24)26)21(23)13-8-4-3-7-12(13)20(16,22)14-9-5-6-10-15(14)21/h2-10,16-17H,1,11H2InChIKey
OBFRBSYBIWPVFR-UHFFFAOYSA-NSynonyms
18dibromo17(prop2en1yl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C=CCN1C(=O)C2C(C1=O)C3(C4=CC=CC=C4C2(C5=CC=CC=C53)Br)Br
InChI=1SC21H15Br2NO2c12112418(25)1617(19(24)26)21(23)13843712(13)20(1622)149561015(14)21h2101617H111H2
MFCD00828204
ZINC000002187732
ZINC000017778759
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