Vitas-M small molecule compound
(5Z)-5-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176604
SMILES C#CCOc1ccc(cc1OCC)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC
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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 C23H20N2O6 MW 420.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O6/c1-4-12-31-19-11-6-15(14-20(19)30-5-2)13-18-21(26)24-23(28)25(22(18)27)16-7-9-17(29-3)10-8-16/h1,6-11,13-14H,5,12H2,2-3H3,(H,24,26,28)/b18-13-InChIKey
KCZFHOSDVYYFEH-AQTBWJFISA-NSynonyms
(5Z)5((3ethoxy4prop2ynoxyphenyl)methylidene)1(4methoxyphenyl)13diazinane246trione
(5Z)5(3ETHOXY4(PROP2YN1YLOXY)BENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
C#CCOc1ccc(cc1OCC)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC)OCC#C
InChI=1SC23H20N2O6c1412311911615(1420(19)3052)131821(26)2423(28)25(22(18)27)167917(293)10816h16111314H512H223H3(H242628)b1813
MFCD02623678
ZINC000014011150
ZINC14011150
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