Vitas-M small molecule compound

(5Z)-5-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-methoxybenzylidene)-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK075030
SMILES COc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)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 C31H32N2O6 MW 528.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O6/c1-5-21(3)23-9-13-25(14-10-23)38-16-17-39-27-15-8-22(19-28(27)37-4)18-26-29(34)32-31(36)33(30(26)35)24-11-6-20(2)7-12-24/h6-15,18-19,21H,5,16-17H2,1-4H3,(H,32,34,36)/b26-18-
InChIKey
FYXRLAXBSSMENR-ITYLOYPMSA-N
Synonyms

(5Z)5((4(2(4butan2ylphenoxy)ethoxy)3methoxyphenyl)methylidene)1(4methylphenyl)13diazinane246trione
(5Z)5(4(2(4(BUTAN2YL)PHENOXY)ETHOXY)3METHOXYBENZYLIDENE)1(4METHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
5((3METHOXY4(2(4(METHYLPROPYL)PHENOXY)ETHOXY)PHENYL)METHYLENE)1(4METHYLPHENYL)13DIHYDROPYRIMIDINE246TRIONE
CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)C)OC
COc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
InChI=1SC31H32N2O6c1521(3)2391325(141023)381617392715822(1928(27)374)182629(34)3231(36)33(30(26)35)2411620(2)71224h615181921H51617H214H3(H323436)b2618
MFCD01873493
STK075030
ZINC000008843089
ZINC000013899205

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Available files

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