Vitas-M small molecule compound

{2-[(Z)-(1-hexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}acetic acid

Catalog ID
STK526286
SMILES CCCCCCN1C(=O)NC(=O)/C(=C/c2ccccc2OCC(=O)O)/C1=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 C19H22N2O6 MW 374.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O6/c1-2-3-4-7-10-21-18(25)14(17(24)20-19(21)26)11-13-8-5-6-9-15(13)27-12-16(22)23/h5-6,8-9,11H,2-4,7,10,12H2,1H3,(H,22,23)(H,20,24,26)/b14-11-
InChIKey
PACWITHATJNNSY-KAMYIIQDSA-N
Synonyms

(2((Z)(1hexyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
(Z)2(2((1hexyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(2((Z)(1HEXYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
CCCCCCN1C(=O)C(=CC2=CC=CC=C2OCC(=O)O)C(=O)NC1=O
CCCCCCN1C(=O)NC(=O)C(=Cc2ccccc2OCC(=O)O)C1=O
InChI=1SC19H22N2O6c12347102118(25)14(17(24)2019(21)26)1113856915(13)271216(22)23h568911H2471012H21H3(H2223)(H202426)b1411
MFCD01959390
ZINC000004833463
ZINC4833463

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Available files

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