Vitas-M small molecule compound
(5E)-5-{1-[(3-fluorobenzyl)amino]ethylidene}-1-[4-(trifluoromethyl)phenyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL447327
SMILES Fc1cccc(c1)CN/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(F)(F)F)/C
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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 C20H15F4N3O3 MW 421.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F4N3O3/c1-11(25-10-12-3-2-4-14(21)9-12)16-17(28)26-19(30)27(18(16)29)15-7-5-13(6-8-15)20(22,23)24/h2-9,25H,10H2,1H3,(H,26,28,30)/b16-11+InChIKey
KEALQJQEYDXMFY-LFIBNONCSA-NSynonyms
(5E)5(1((3fluorobenzyl)amino)ethylidene)1(4(trifluoromethyl)phenyl)pyrimidine246(1H3H5H)trione
(5E)5(1((3fluorophenyl)methylamino)ethylidene)1(4(trifluoromethyl)phenyl)13diazinane246trione
CC(=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)C(F)(F)F)NCC3=CC(=CC=C3)F
Fc1cccc(c1)CNC(=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(F)(F)F)C
InChI=1SC20H15F4N3O3c111(25101232414(21)912)1617(28)2619(30)27(18(16)29)157513(6815)20(2223)24h2925H10H21H3(H262830)b1611+
MFCD06243593
ZINC000001407376
ZINC1407376
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