Vitas-M small molecule compound
1',3'-bis(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
STL563809
SMILES Cc1ccc(cc1)N1C(=O)N(c2ccc(cc2)C)C(=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 C35H31N5O5 MW 601.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H31N5O5/c1-23-8-12-27(13-9-23)38-32(41)35(33(42)39(34(38)43)28-14-10-24(2)11-15-28)21-25-20-29(40(44)45)16-17-30(25)37-19-18-36(22-31(35)37)26-6-4-3-5-7-26/h3-17,20,31H,18-19,21-22H2,1-2H3InChIKey
NJNHXZNWJDRKPE-UHFFFAOYSA-NSynonyms
879442-40-713bis(4methylphenyl)8nitro3phenyl2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
13bis(4methylphenyl)8nitro3phenylspiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
17579542
879442407
8nitro3phenyl13diptolyl12344a6hexahydro1Hspiro(pyrazino(12a)quinoline55pyrimidine)246(3H)trione
Cc1ccc(cc1)N1C(=O)N(c2ccc(cc2)C)C(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1)(N+)(=O)(O)
InChI=1SC35H31N5O5c12381227(13923)3832(41)35(33(42)39(34(38)43)28141024(2)111528)21252029(40(44)45)161730(25)37191836(2231(35)37)266435726h3172031H18192122H212H3
MFCD07204335
ZINC000097956982
ZINC000097956983
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