Vitas-M small molecule compound

1,1'-[1-(5-bromo-2-hydroxyphenyl)-2,5-dimethyl-1H-pyrrole-3,4-diyl]diethanone

Catalog ID
STK001819
SMILES Brc1ccc(c(c1)n1c(C)c(c(c1C)C(=O)C)C(=O)C)O

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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 C16H16BrNO3 MW 350.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrNO3/c1-8-15(10(3)19)16(11(4)20)9(2)18(8)13-7-12(17)5-6-14(13)21/h5-7,21H,1-4H3
InChIKey
GLVQHNHIFIQXKH-UHFFFAOYSA-N
Synonyms

1(4ACETYL1(5BROMO2HYDROXYPHENYL)25DIMETHYLPYRROL3YL)ETHANONE
11(1(5BROMO2HYDROXYPHENYL)25DIMETHYL1HPYRROLE34DIYL)DIETHANONE
Brc1ccc(c(c1)n1c(C)c(c(c1C)C(=O)C)C(=O)C)O
CC1=C(C(=C(N1C2=C(C=CC(=C2)Br)O)C)C(=O)C)C(=O)C
InChI=1SC16H16BrNO3c1815(10(3)19)16(11(4)20)9(2)18(8)13712(17)5614(13)21h5721H14H3
MFCD03249031
STK001819
ZINC000004548189
ZINC04548189
ZINC4548189

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.