Vitas-M small molecule compound
(5E)-5-[3,5-dichloro-4-(prop-2-yn-1-yloxy)benzylidene]-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175229
SMILES C#CCOc1c(Cl)cc(cc1Cl)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)CC
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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 C22H16Cl2N2O4 MW 443.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl2N2O4/c1-3-9-30-19-17(23)11-14(12-18(19)24)10-16-20(27)25-22(29)26(21(16)28)15-7-5-13(4-2)6-8-15/h1,5-8,10-12H,4,9H2,2H3,(H,25,27,29)/b16-10+InChIKey
NYYIIMLZJSMMQK-MHWRWJLKSA-NSynonyms
(5E)5((35DICHLORO4PROP2YNOXYPHENYL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5(35DICHLORO4(PROP2YN1YLOXY)BENZYLIDENE)1(4ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
C#CCOc1c(Cl)cc(cc1Cl)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)CC
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC#C)Cl)C(=O)NC2=O
InChI=1SC22H16Cl2N2O4c139301917(23)1114(1218(19)24)101620(27)2522(29)26(21(16)28)157513(42)6815h1581012H49H22H3(H252729)b1610+
MFCD04562688
ZINC000003463854
ZINC03463854
ZINC3463854
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