Vitas-M small molecule compound
1'-tert-butyl-3-methyl-8-nitro-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
STK785712
SMILES CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)C(C)(C)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 C20H25N5O5 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O5/c1-19(2,3)24-17(27)20(16(26)21-18(24)28)10-12-9-13(25(29)30)5-6-14(12)23-8-7-22(4)11-15(20)23/h5-6,9,15H,7-8,10-11H2,1-4H3,(H,21,26,28)InChIKey
JITQOXBPJHLUPR-UHFFFAOYSA-NSynonyms
(4aR5R)1(tertbutyl)3methyl8nitro12344a6hexahydro1Hspiro(pyrazino(12a)quinoline55pyrimidine)246(3H)trione
1tertbutyl3methyl8nitro2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
1tertbutyl3methyl8nitrospiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
CN1CCN2(C@@H)(C1)(C@)1(Cc3c2ccc(c3)(N+)(=O)(O))C(=O)NC(=O)N(C1=O)C(C)(C)C
CN1CCN2C(C1)C1(Cc3c2ccc(c3)(N+)(=O)(O))C(=O)NC(=O)N(C1=O)C(C)(C)C
InChI=1SC20H25N5O5c119(23)2417(27)20(16(26)2118(24)28)1012913(25(29)30)5614(12)238722(4)1115(20)23h56915H781011H214H3(H212628)
MFCD07800318
ZINC000055246753
Check stock
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Check stock on Vitas-MAvailable files
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