Vitas-M small molecule compound

5-(2,5-dimethyl-3-{(E)-[2-(pyridin-3-ylcarbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzene-1,3-dicarboxylic acid

Catalog ID
STK198050
SMILES O=C(c1cccnc1)N/N=C/c1cc(n(c1C)c1cc(cc(c1)C(=O)O)C(=O)O)C

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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 C21H18N4O5 MW 406.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O5/c1-12-6-17(11-23-24-19(26)14-4-3-5-22-10-14)13(2)25(12)18-8-15(20(27)28)7-16(9-18)21(29)30/h3-11H,1-2H3,(H,24,26)(H,27,28)(H,29,30)/b23-11+
InChIKey
XDQKCAWQHDLFBJ-FOKLQQMPSA-N
Synonyms
638993-37-0
5(25DIMETHYL3((E)(2(PYRIDIN3YLCARBONYL)HYDRAZINYLIDENE)METHYL)1HPYRROL1YL)BENZENE13DICARBOXYLICACID
5(25dimethyl3((E)(pyridine3carbonylhydrazinylidene)methyl)pyrrol1yl)benzene13dicarboxylicacid
638993370
CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)O)C(=O)O)C)C=NNC(=O)C3=CN=CC=C3
InChI=1SC21H18N4O5c112617(11232419(26)14435221014)13(2)25(12)18815(20(27)28)716(918)21(29)30h311H12H3(H2426)(H2728)(H2930)b2311+
MFCD03827004
O=C(c1cccnc1)NN=Cc1cc(n(c1C)c1cc(cc(c1)C(=O)O)C(=O)O)C
ZINC000004739146
ZINC36145017

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Available files

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