Vitas-M small molecule compound
1-bromo-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
STK386210
SMILES COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(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 C25H18BrNO3 MW 460.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrNO3/c1-30-15-12-10-14(11-13-15)27-23(28)21-20-16-6-2-4-8-18(16)25(26,22(21)24(27)29)19-9-5-3-7-17(19)20/h2-13,20-22H,1H3InChIKey
GIUXJBYARNJFGJ-UHFFFAOYSA-NSynonyms
1bromo17(4methoxyphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
COC1=CC=C(C=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)Br
InChI=1SC25H18BrNO3c13015121014(111315)2723(28)212016624818(16)25(2622(21)24(27)29)19953717(19)20h2132022H1H3
MFCD00345805
ZINC000002473582
ZINC000002473585
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