Vitas-M small molecule compound
(5Z)-1-(4-chlorophenyl)-5-{4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK007462
SMILES CCOc1cc(ccc1OCCOc1ccc(c(c1)C)C)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)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 C29H27ClN2O6 MW 535.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O6/c1-4-36-26-17-20(6-12-25(26)38-14-13-37-23-11-5-18(2)19(3)15-23)16-24-27(33)31-29(35)32(28(24)34)22-9-7-21(30)8-10-22/h5-12,15-17H,4,13-14H2,1-3H3,(H,31,33,35)/b24-16-InChIKey
WIXLBWMAZALKKN-JLPGSUDCSA-NSynonyms
(5Z)1(4chlorophenyl)5((4(2(34dimethylphenoxy)ethoxy)3ethoxyphenyl)methylidene)13diazinane246trione
(5Z)1(4CHLOROPHENYL)5(4(2(34DIMETHYLPHENOXY)ETHOXY)3ETHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)OCCOC4=CC(=C(C=C4)C)C
CCOc1cc(ccc1OCCOc1ccc(c(c1)C)C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
InChI=1SC29H27ClN2O6c1436261720(61225(26)381413372311518(2)19(3)1523)162427(33)3129(35)32(28(24)34)229721(30)81022h5121517H41314H213H3(H313335)b2416
MFCD05975960
STK007462
ZINC000097957819
ZINC97957819
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