Vitas-M small molecule compound

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

Catalog ID
STL038387
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)c1nc2c(s1)cc(cc2)OC)/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/c1-4-35-19-11-9-18(10-12-19)25(31)23-24(17-7-5-16(2)6-8-17)30(27(33)26(23)32)28-29-21-14-13-20(34-3)15-22(21)36-28/h5-15,24,31H,4H2,1-3H3/b25-23+
InChIKey
MDLNDNONNFTVOO-WJTDDFOZSA-N
Synonyms
514187-39-4
(4E)4((4ethoxyphenyl)(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)5(4methylphenyl)pyrrolidine23dione
(4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(6METHOXY13BENZOTHIAZOL2YL)5(4METHYLPHENYL)PYRROLIDINE23DIONE
4((4ETHOXYPHENYL)CARBONYL)3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)5(4METHYLPHENYL)3PYRROLIN2ONE
514187394
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)OC)C5=CC=C(C=C5)C)O
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C)c1nc2c(s1)cc(cc2)OC)O
InChI=1SC28H24N2O5Sc14351911918(101219)25(31)2324(177516(2)6817)30(27(33)26(23)32)282921141320(343)1522(21)3628h5152431H4H213H3b2523+
MFCD03819096
ZINC000102861613
ZINC000102861617

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Available files

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