Vitas-M small molecule compound

17-(3-bromophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carboxylic acid (non-preferred name)

Catalog ID
STK325345
SMILES Brc1cccc(c1)N1C(=O)C2C(C1=O)C1(C(=O)O)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 C25H16BrNO4 MW 474.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16BrNO4/c26-13-6-5-7-14(12-13)27-22(28)20-19-15-8-1-3-10-17(15)25(24(30)31,21(20)23(27)29)18-11-4-2-9-16(18)19/h1-12,19-21H,(H,30,31)
InChIKey
ABZHWZVVGOWDJC-UHFFFAOYSA-N
Synonyms

17(3bromophenyl)1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1carboxylicacid(nonpreferredname)
C1=CC=C2C(=C1)C3C4C(C2(C5=CC=CC=C35)C(=O)O)C(=O)N(C4=O)C6=CC(=CC=C6)Br
InChI=1SC25H16BrNO4c261365714(1213)2722(28)2019158131017(15)25(24(30)3121(20)23(27)29)181142916(18)19h1121921H(H3031)
MFCD01593973
ZINC000002503359
ZINC000002503362

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Available files

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