Vitas-M small molecule compound
3-(2-methoxyphenyl)-1'-phenyl-8-(trifluoromethyl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Catalog ID
STL437810
SMILES COc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)C(F)(F)F)C(=O)NC(=O)N(C1=O)c1ccccc1
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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 C29H25F3N4O4 MW 550.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25F3N4O4/c1-40-23-10-6-5-9-22(23)34-13-14-35-21-12-11-19(29(30,31)32)15-18(21)16-28(24(35)17-34)25(37)33-27(39)36(26(28)38)20-7-3-2-4-8-20/h2-12,15,24H,13-14,16-17H2,1H3,(H,33,37,39)InChIKey
CYDBEFKLZRPVJK-UHFFFAOYSA-NSynonyms
3(2methoxyphenyl)1phenyl8(trifluoromethyl)2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
3(2methoxyphenyl)1phenyl8(trifluoromethyl)spiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
COC1=CC=CC=C1N2CCN3C(C2)C4(CC5=C3C=CC(=C5)C(F)(F)F)C(=O)NC(=O)N(C4=O)C6=CC=CC=C6
InChI=1SC29H25F3N4O4c140231065922(23)3413143521121119(29(3031)32)1518(21)1628(24(35)1734)25(37)3327(39)36(26(28)38)207324820h2121524H13141617H21H3(H333739)
MFCD08273140
ZINC000008694631
ZINC000248119221
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