Vitas-M small molecule compound

5-cyano-4-methyl-1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxylic acid

Catalog ID
STK278384
SMILES N#Cc1c(C)c(nn(c1=O)c1ccc(cc1)C)C(=O)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 C14H11N3O3 MW 269.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O3/c1-8-3-5-10(6-4-8)17-13(18)11(7-15)9(2)12(16-17)14(19)20/h3-6H,1-2H3,(H,19,20)
InChIKey
WUOVOAAHOCKBSS-UHFFFAOYSA-N
Synonyms
128639-56-5
128639565
5cyano4methyl1(4methylphenyl)6oxo16dihydropyridazine3carboxylicacid
5CYANO4METHYL1(4METHYLPHENYL)6OXOPYRIDAZINE3CARBOXYLICACID
5CYANO4METHYL6OXO1PTOLYL16DIHYDROPYRIDAZINE3CARBOXYLICACID
CC1=CC=C(C=C1)N2C(=O)C(=C(C(=N2)C(=O)O)C)C#N
InChI=1SC14H11N3O3c183510(648)1713(18)11(715)9(2)12(1617)14(19)20h36H12H3(H1920)
MFCD04608703
ZINC000000796947
ZINC796947

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Available files

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