Vitas-M small molecule compound
(5E)-5-[{[2-(1H-imidazol-5-yl)ethyl]amino}(4-methylphenyl)methylidene]-1-[2-(trifluoromethyl)phenyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL447881
SMILES Cc1ccc(cc1)/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1C(F)(F)F)/NCCc1[nH]cnc1
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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 C24H20F3N5O3 MW 483.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20F3N5O3/c1-14-6-8-15(9-7-14)20(29-11-10-16-12-28-13-30-16)19-21(33)31-23(35)32(22(19)34)18-5-3-2-4-17(18)24(25,26)27/h2-9,12-13,29H,10-11H2,1H3,(H,28,30)(H,31,33,35)/b20-19+InChIKey
TWXTZOBNLKKLGE-FMQUCBEESA-NSynonyms
(5E)5(((2(1Himidazol5yl)ethyl)amino)(4methylphenyl)methylidene)1(2(trifluoromethyl)phenyl)pyrimidine246(1H3H5H)trione
(5E)5((2(1Himidazol5yl)ethylamino)(4methylphenyl)methylidene)1(2(trifluoromethyl)phenyl)13diazinane246trione
CC1=CC=C(C=C1)C(=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3C(F)(F)F)NCCC4=CN=CN4
Cc1ccc(cc1)C(=C1C(=O)NC(=O)N(C1=O)c1ccccc1C(F)(F)F)NCCc1(nH)cnc1
InChI=1SC24H20F3N5O3c1146815(9714)20(291110161228133016)1921(33)3123(35)32(22(19)34)18532417(18)24(2526)27h29121329H1011H21H3(H2830)(H313335)b2019+
MFCD07756100
ZINC000101382306
ZINC101382306
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