Vitas-M small molecule compound
methyl (1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetate (non-preferred name)
Catalog ID
STK268449
SMILES COC(=O)CN1C(=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 C21H15Br2NO4 MW 505.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Br2NO4/c1-28-15(25)10-24-18(26)16-17(19(24)27)21(23)12-7-3-2-6-11(12)20(16,22)13-8-4-5-9-14(13)21/h2-9,16-17H,10H2,1H3InChIKey
QTQVIERYYHKCCU-UHFFFAOYSA-NSynonyms
COC(=O)CN1C(=O)C2C(C1=O)C3(C4=CC=CC=C4C2(C5=CC=CC=C53)Br)Br
InChI=1SC21H15Br2NO4c12815(25)102418(26)1617(19(24)27)21(23)12732611(12)20(1622)13845914(13)21h291617H10H21H3
methyl(18dibromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)acetate(nonpreferredname)
MFCD01156474
ZINC000002068169
ZINC000013603033
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