Vitas-M small molecule compound

{4-[(Z)-{1-[4-(butan-2-yl)phenyl]-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene}methyl]-2-methoxyphenoxy}acetic acid

Catalog ID
STK712579
SMILES COc1cc(ccc1OCC(=O)O)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(CC)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 C24H24N2O7 MW 452.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O7/c1-4-14(2)16-6-8-17(9-7-16)26-23(30)18(22(29)25-24(26)31)11-15-5-10-19(20(12-15)32-3)33-13-21(27)28/h5-12,14H,4,13H2,1-3H3,(H,27,28)(H,25,29,31)/b18-11-
InChIKey
YMGAZZXHMLAKGP-WQRHYEAKSA-N
Synonyms
799795-27-0
(4((Z)(1(4(butan2yl)phenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxyphenoxy)aceticacid
(Z)2(4((1(4(secbutyl)phenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxyphenoxy)aceticacid
2(4((Z)(1(4BUTAN2YLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETICACID
799795270
CCC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)OC)C(=O)NC2=O
COc1cc(ccc1OCC(=O)O)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(CC)C
InChI=1SC24H24N2O7c1414(2)166817(9716)2623(30)18(22(29)2524(26)31)111551019(20(1215)323)331321(27)28h51214H413H213H3(H2728)(H252931)b1811
MFCD03677259
ZINC000013662081
ZINC000020171930

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Available files

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