Vitas-M small molecule compound
1'-(4-methylphenyl)-8-nitro-3-phenyl-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
STK589671
SMILES Cc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1)[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 C28H25N5O5 MW 511.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O5/c1-18-7-9-21(10-8-18)32-26(35)28(25(34)29-27(32)36)16-19-15-22(33(37)38)11-12-23(19)31-14-13-30(17-24(28)31)20-5-3-2-4-6-20/h2-12,15,24H,13-14,16-17H2,1H3,(H,29,34,36)InChIKey
DZRGLNXCCCNLEP-UHFFFAOYSA-NSynonyms
879769-10-51(4methylphenyl)8nitro3phenyl2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
1(4methylphenyl)8nitro3phenylspiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
879769105
8nitro3phenyl1(ptolyl)12344a6hexahydro1Hspiro(pyrazino(12a)quinoline55pyrimidine)246(3H)trione
CC1=CC=C(C=C1)N2C(=O)C3(CC4=C(C=CC(=C4)(N+)(=O)(O))N5C3CN(CC5)C6=CC=CC=C6)C(=O)NC2=O
Cc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1)(N+)(=O)(O)
InChI=1SC28H25N5O5c1187921(10818)3226(35)28(25(34)2927(32)36)16191522(33(37)38)111223(19)31141330(1724(28)31)205324620h2121524H13141617H21H3(H293436)
MFCD07639676
ZINC000009129111
ZINC000229905464
Check stock
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Check stock on Vitas-MAvailable files
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