Vitas-M small molecule compound
7'-{(E)-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-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
STL056743
SMILES C=CCN1C(=O)N=C(/C(=C\c2ccc3c(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 C25H25N5O6 MW 491.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O6/c1-4-9-30-20(32)16(19(31)26-23(30)35)12-14-7-8-17-15(11-14)13-25(18-6-5-10-29(17)18)21(33)27(2)24(36)28(3)22(25)34/h4,7-8,11-12,18H,1,5-6,9-10,13H2,2-3H3,(H,26,31,35)/b16-12+InChIKey
QOLPBFNYCIQHLN-FOWTUZBSSA-NSynonyms
892620-41-613dimethyl7((E)(246trioxo1prop2enyl13diazinan5ylidene)methyl)spiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
7((E)(4hydroxy26dioxo1(prop2en1yl)16dihydropyrimidin5(2H)ylidene)methyl)13dimethyl1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trion
892620416
C=CCN1C(=O)N=C(C(=Cc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C1=O)O
CN1C(=O)C2(CC3=C(C=CC(=C3)C=C4C(=O)NC(=O)N(C4=O)CC=C)N5C2CCC5)C(=O)N(C1=O)C
InChI=1SC25H25N5O6c1493020(32)16(19(31)2623(30)35)1214781715(1114)1325(18651029(17)18)21(33)27(2)24(36)28(3)22(25)34h478111218H15691013H223H3(H263135)b1612+
MFCD07212548
ZINC000008969970
ZINC000009233090
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.