Vitas-M small molecule compound
1'-(4-methoxyphenyl)-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
STK685541
SMILES COc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(C)CC1)[N+](=O)[O-]
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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 C23H23N5O6 MW 465.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O6/c1-25-9-10-26-18-8-5-16(28(32)33)11-14(18)12-23(19(26)13-25)20(29)24-22(31)27(21(23)30)15-3-6-17(34-2)7-4-15/h3-8,11,19H,9-10,12-13H2,1-2H3,(H,24,29,31)InChIKey
POOGYTSAJYJEBF-UHFFFAOYSA-NSynonyms
1(4methoxyphenyl)3methyl8nitro2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
1(4methoxyphenyl)3methyl8nitrospiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
CN1CCN2C(C1)C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)C5=CC=C(C=C5)OC
COc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(C)CC1)(N+)(=O)(O)
InChI=1SC23H23N5O6c12591026188516(28(32)33)1114(18)1223(19(26)1325)20(29)2422(31)27(21(23)30)153617(342)7415h381119H9101213H212H3(H242931)
MFCD05859459
ZINC000012416769
ZINC000230037917
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