Vitas-M small molecule compound

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

Catalog ID
STK566046
SMILES CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C)/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 C28H24N2O5S MW 500.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O5S/c1-4-35-20-13-14-21-22(15-20)36-28(29-21)30-24(17-7-5-16(2)6-8-17)23(26(32)27(30)33)25(31)18-9-11-19(34-3)12-10-18/h5-15,24,31H,4H2,1-3H3/b25-23+
InChIKey
UDETZAVCIXRWOY-WJTDDFOZSA-N
Synonyms
514193-18-1
(4E)1(6ethoxy13benzothiazol2yl)4(hydroxy(4methoxyphenyl)methylidene)5(4methylphenyl)pyrrolidine23dione
1(6ETHOXYBENZOTHIAZOL2YL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)5(4METHYLPHENYL)3PYRROLIN2ONE
514193181
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OC)O)C(=O)C3=O)C5=CC=C(C=C5)C
CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C)C(=C(c2ccc(cc2)OC)O)C(=O)C1=O
InChI=1SC28H24N2O5Sc14352013142122(1520)3628(2921)3024(177516(2)6817)23(26(32)27(30)33)25(31)1891119(343)121018h5152431H4H213H3b2523+
MFCD03801180
ZINC000102539084
ZINC000102539090

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Available files

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