Vitas-M small molecule compound
7'-({(Z)-[4-hydroxy-1-(4-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)-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
STK574071
SMILES Cc1ccc(cc1)N1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=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 C29H28N6O6 MW 556.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O6/c1-16-6-9-19(10-7-16)35-24(37)20(23(36)31-27(35)40)15-30-18-8-11-21-17(13-18)14-29(22-5-4-12-34(21)22)25(38)32(2)28(41)33(3)26(29)39/h6-11,13,15,22,30H,4-5,12,14H2,1-3H3,(H,31,36,40)/b20-15-InChIKey
BMIRMFGXPAUWBL-HKWRFOASSA-NSynonyms
7(((Z)(4hydroxy1(4methylphenyl)26dioxo16dihydropyrimidin5(2H)ylidene)methyl)amino)13dimethyl1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H
Cc1ccc(cc1)N1C(=O)N=C(C(=CNc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C1=O)O
MFCD07206514
ZINC000097967872
ZINC000097967873
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