Vitas-M small molecule compound

(4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione

Catalog ID
STK560797
SMILES CCOc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)OC)/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C1=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 C28H24N2O6S MW 516.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O6S/c1-4-36-20-12-13-21-22(15-20)37-28(29-21)30-24(17-6-5-7-19(14-17)35-3)23(26(32)27(30)33)25(31)16-8-10-18(34-2)11-9-16/h5-15,24,31H,4H2,1-3H3/b25-23+
InChIKey
IODHWQYGKVXAJQ-WJTDDFOZSA-N
Synonyms
514193-30-7
(4E)1(6ethoxy13benzothiazol2yl)4(hydroxy(4methoxyphenyl)methylidene)5(3methoxyphenyl)pyrrolidine23dione
1(6ETHOXYBENZOTHIAZOL2YL)3HYDROXY5(3METHOXYPHENYL)4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
514193307
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OC)O)C(=O)C3=O)C5=CC(=CC=C5)OC
CCOc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)OC)C(=C(c2ccc(cc2)OC)O)C(=O)C1=O
InChI=1SC28H24N2O6Sc14362012132122(1520)3728(2921)3024(1765719(1417)353)23(26(32)27(30)33)25(31)1681018(342)11916h5152431H4H213H3b2523+
MFCD03796622
ZINC000102498996
ZINC000102499005

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Available files

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