Vitas-M small molecule compound

(2,6-dichloro-4-{(Z)-[1-(3,5-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid

Catalog ID
STK613297
SMILES OC(=O)COc1c(Cl)cc(cc1Cl)/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)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 C21H16Cl2N2O6 MW 463.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2N2O6/c1-10-3-11(2)5-13(4-10)25-20(29)14(19(28)24-21(25)30)6-12-7-15(22)18(16(23)8-12)31-9-17(26)27/h3-8H,9H2,1-2H3,(H,26,27)(H,24,28,30)/b14-6-
InChIKey
POEMYFVDDJBFRF-NSIKDUERSA-N
Synonyms
347380-25-0
(26dichloro4((Z)(1(35dimethylphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(26DICHLORO4((Z)(1(35DIMETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
347380250
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC(=O)O)Cl)C(=O)NC2=O)C
InChI=1SC21H16Cl2N2O6c110311(2)513(410)2520(29)14(19(28)2421(25)30)612715(22)18(16(23)812)31917(26)27h38H9H212H3(H2627)(H242830)b146
MFCD08732262
OC(=O)COc1c(Cl)cc(cc1Cl)C=C1C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O
ZINC000013810507
ZINC13810507

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Available files

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