Vitas-M small molecule compound

7'-[(E)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione

Catalog ID
STK576495
SMILES OC1=NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)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 C28H25N5O6 MW 527.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O6/c1-30-24(36)28(25(37)31(2)27(30)39)15-17-13-16(10-11-20(17)32-12-6-9-21(28)32)14-19-22(34)29-26(38)33(23(19)35)18-7-4-3-5-8-18/h3-5,7-8,10-11,13-14,21H,6,9,12,15H2,1-2H3,(H,29,34,38)/b19-14+
InChIKey
STYWODJOAQNHTJ-XMHGGMMESA-N
Synonyms
892635-66-4
13dimethyl7((E)(246trioxo1phenyl13diazinan5ylidene)methyl)spiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
7((E)(4hydroxy26dioxo1phenyl16dihydropyrimidin5(2H)ylidene)methyl)13dimethyl1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trione
892635664
CN1C(=O)C2(CC3=C(C=CC(=C3)C=C4C(=O)NC(=O)N(C4=O)C5=CC=CC=C5)N6C2CCC6)C(=O)N(C1=O)C
InChI=1SC28H25N5O6c13024(36)28(25(37)31(2)27(30)39)15171316(101120(17)32126921(28)32)141922(34)2926(38)33(23(19)35)187435818h35781011131421H691215H212H3(H293438)b1914+
MFCD07211905
ZINC000002205363
ZINC000097967917

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Available files

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