Vitas-M small molecule compound
1'-(1,3-benzodioxol-5-yl)-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
STL437762
SMILES O=C1NC(=O)C2(C(=O)N1c1ccc3c(c1)OCO3)Cc1ccccc1N1C2COCC1
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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 C22H19N3O6 MW 421.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O6/c26-19-22(10-13-3-1-2-4-15(13)24-7-8-29-11-18(22)24)20(27)25(21(28)23-19)14-5-6-16-17(9-14)31-12-30-16/h1-6,9,18H,7-8,10-12H2,(H,23,26,28)InChIKey
VBSJTKKSKXYAHT-UHFFFAOYSA-NSynonyms
1(13benzodioxol5yl)1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)246(1H3H)trione
1(13benzodioxol5yl)spiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
C1COCC2N1C3=CC=CC=C3CC24C(=O)NC(=O)N(C4=O)C5=CC6=C(C=C5)OCO6
InChI=1SC22H19N3O6c261922(1013312415(13)2478291118(22)24)20(27)25(21(28)2319)14561617(914)31123016h16918H781012H2(H232628)
MFCD08273114
ZINC000008695444
ZINC000008695447
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