Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK099186
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCOc1ccc(c(c1)C)C)Cl
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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 C29H26Cl2N2O6 MW 569.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26Cl2N2O6/c1-4-37-25-16-19(15-24(31)26(25)39-12-11-38-22-10-5-17(2)18(3)13-22)14-23-27(34)32-29(36)33(28(23)35)21-8-6-20(30)7-9-21/h5-10,13-16H,4,11-12H2,1-3H3,(H,32,34,36)/b23-14-InChIKey
LJSDUROEVVDLML-UCQKPKSFSA-NSynonyms
(5Z)5((3chloro4(2(34dimethylphenoxy)ethoxy)5ethoxyphenyl)methylidene)1(4chlorophenyl)13diazinane246trione
(5Z)5(3CHLORO4(2(34DIMETHYLPHENOXY)ETHOXY)5ETHOXYBENZYLIDENE)1(4CHLOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)Cl)OCCOC4=CC(=C(C=C4)C)C
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCOc1ccc(c(c1)C)C)Cl
InChI=1SC29H26Cl2N2O6c1437251619(1524(31)26(25)391211382210517(2)18(3)1322)142327(34)3229(36)33(28(23)35)218620(30)7921h5101316H41112H213H3(H323436)b2314
MFCD05975998
STK099186
ZINC000097959463
ZINC97959463
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