Vitas-M small molecule compound
(5Z)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484430
SMILES C#CCOc1ccc(cc1OCC)/C=C\1/C(=O)NC(=O)N(C1=O)c1cc(ccc1Cl)C(F)(F)F
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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 C23H16ClF3N2O5 MW 492.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClF3N2O5/c1-3-9-34-18-8-5-13(11-19(18)33-4-2)10-15-20(30)28-22(32)29(21(15)31)17-12-14(23(25,26)27)6-7-16(17)24/h1,5-8,10-12H,4,9H2,2H3,(H,28,30,32)/b15-10-InChIKey
WNQAEKWCCRSMRL-GDNBJRDFSA-NSynonyms
(5Z)1(2CHLORO5(TRIFLUOROMETHYL)PHENYL)5((3ETHOXY4PROP2YNOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(2chloro5(trifluoromethyl)phenyl)5(3ethoxy4(prop2yn1yloxy)benzylidene)pyrimidine246(1H3H5H)trione
C#CCOc1ccc(cc1OCC)C=C1C(=O)NC(=O)N(C1=O)c1cc(ccc1Cl)C(F)(F)F
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)OCC#C
InChI=1SC23H16ClF3N2O5c13934188513(1119(18)3342)101520(30)2822(32)29(21(15)31)171214(23(2526)27)6716(17)24h1581012H49H22H3(H283032)b1510
MFCD02640101
ZINC000015821564
ZINC15821564
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