Vitas-M small molecule compound

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

Catalog ID
STL148771
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/O)/C1c1ccccc1OC

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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/c1-4-36-18-13-14-20-22(15-18)37-28(29-20)30-24(19-7-5-6-8-21(19)35-3)23(26(32)27(30)33)25(31)16-9-11-17(34-2)12-10-16/h5-15,24,31H,4H2,1-3H3/b25-23+
InChIKey
BOIKGVJRGJBUJZ-WJTDDFOZSA-N
Synonyms
514193-29-4
(4E)1(6ethoxy13benzothiazol2yl)4(hydroxy(4methoxyphenyl)methylidene)5(2methoxyphenyl)pyrrolidine23dione
1(6ETHOXYBENZOTHIAZOL2YL)3HYDROXY5(2METHOXYPHENYL)4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
514193294
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=C5OC
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc(cc2)OC)O)C1c1ccccc1OC
InChI=1SC28H24N2O6Sc14361813142022(1518)3728(2920)3024(19756821(19)353)23(26(32)27(30)33)25(31)1691117(342)121016h5152431H4H213H3b2523+
MFCD03799073
ZINC000102927888
ZINC000102927890

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Available files

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