Vitas-M small molecule compound
1'-phenyl-8-(trifluoromethyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Catalog ID
STL437769
SMILES O=C1NC(=O)C2(C(=O)N1c1ccccc1)Cc1cc(ccc1N1C2COCC1)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 C22H18F3N3O4 MW 445.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3N3O4/c23-22(24,25)14-6-7-16-13(10-14)11-21(17-12-32-9-8-27(16)17)18(29)26-20(31)28(19(21)30)15-4-2-1-3-5-15/h1-7,10,17H,8-9,11-12H2,(H,26,29,31)InChIKey
ZPPJXXSXZFDYCE-UHFFFAOYSA-NSynonyms
1phenyl8(trifluoromethyl)1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)246(1H3H)trione
1phenyl8(trifluoromethyl)spiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
C1COCC2N1C3=C(CC24C(=O)NC(=O)N(C4=O)C5=CC=CC=C5)C=C(C=C3)C(F)(F)F
InChI=1SC22H18F3N3O4c2322(2425)14671613(1014)1121(1712329827(16)17)18(29)2620(31)28(19(21)30)154213515h171017H891112H2(H262931)
MFCD08273117
ZINC000008695454
ZINC000247695437
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