Vitas-M small molecule compound

4-{[2-(2-{(Z)-[1-(2,4-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-3-yl)ethyl]amino}-4-oxobutanoic acid

Catalog ID
STL514384
SMILES O=C(CCC(=O)O)NCCc1c(/C=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2C)C)O)[nH]c2c1cccc2

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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 C27H26N4O6 MW 502.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O6/c1-15-7-8-22(16(2)13-15)31-26(36)19(25(35)30-27(31)37)14-21-18(17-5-3-4-6-20(17)29-21)11-12-28-23(32)9-10-24(33)34/h3-8,13-14,29H,9-12H2,1-2H3,(H,28,32)(H,33,34)(H,30,35,37)/b19-14-
InChIKey
SGYVLKIPDQKRDU-RGEXLXHISA-N
Synonyms

4((2(2((Z)(1(24dimethylphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)1Hindol3yl)ethyl)amino)4oxobutanoicacid
InChI=1SC27H26N4O6c1157822(16(2)1315)3126(36)19(25(35)3027(31)37)142118(17534620(17)2921)11122823(32)91024(33)34h38131429H912H212H3(H2832)(H3334)(H303537)b1914
MFCD05732579
ZINC000020411599

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Available files

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