Vitas-M small molecule compound
(5E)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-6-hydroxy-3-[3-(trifluoromethyl)phenyl]pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL056192
SMILES CCn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F)O
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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 C22H16F3N3O3 MW 427.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F3N3O3/c1-2-27-12-13(16-8-3-4-9-18(16)27)10-17-19(29)26-21(31)28(20(17)30)15-7-5-6-14(11-15)22(23,24)25/h3-12H,2H2,1H3,(H,26,29,31)/b17-10+InChIKey
LKQPOOQJXKIRHG-LICLKQGHSA-NSynonyms
573932-87-3(5E)5((1ethyl1Hindol3yl)methylidene)6hydroxy3(3(trifluoromethyl)phenyl)pyrimidine24(3H5H)dione
(5E)5((1ETHYLINDOL3YL)METHYLIDENE)1(3(TRIFLUOROMETHYL)PHENYL)13DIAZINANE246TRIONE
573932873
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC(=C4)C(F)(F)F
CCn1cc(c2c1cccc2)C=C1C(=NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F)O
InChI=1SC22H16F3N3O3c12271213(16834918(16)27)101719(29)2621(31)28(20(17)30)1575614(1115)22(2324)25h312H2H21H3(H262931)b1710+
MFCD05731018
ZINC000013514507
ZINC13514507
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