Vitas-M small molecule compound
3-ethyl-8-nitro-1'-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
STK784458
SMILES CCN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])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 C23H23N5O5 MW 449.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O5/c1-2-25-10-11-26-18-9-8-17(28(32)33)12-15(18)13-23(19(26)14-25)20(29)24-22(31)27(21(23)30)16-6-4-3-5-7-16/h3-9,12,19H,2,10-11,13-14H2,1H3,(H,24,29,31)InChIKey
DYCVVCHUXHNSEM-UHFFFAOYSA-NSynonyms
727370-72-13ethyl8nitro1phenyl12344a6hexahydro1Hspiro(pyrazino(12a)quinoline55pyrimidine)246(3H)trione
3ethyl8nitro1phenyl2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
3ethyl8nitro1phenylspiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
727370721
CCN1CCN2C(C1)C1(Cc3c2ccc(c3)(N+)(=O)(O))C(=O)NC(=O)N(C1=O)c1ccccc1
CCN1CCN2C(C1)C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)C5=CC=CC=C5
InChI=1SC23H23N5O5c1225101126189817(28(32)33)1215(18)1323(19(26)1425)20(29)2422(31)27(21(23)30)166435716h391219H210111314H21H3(H242931)
MFCD06191501
ZINC000017044010
ZINC000249684698
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