Vitas-M small molecule compound

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

Catalog ID
STL036968
SMILES COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C

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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 C29H26N2O6S MW 530.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O6S/c1-15-6-9-17(10-7-15)25(32)23-24(18-13-20(35-3)27(37-5)21(14-18)36-4)31(28(34)26(23)33)29-30-19-11-8-16(2)12-22(19)38-29/h6-14,24,32H,1-5H3/b25-23+
InChIKey
DZLDANQINPSPSS-WJTDDFOZSA-N
Synonyms
514188-91-1
(4E)4(hydroxy(4methylphenyl)methylidene)1(6methyl13benzothiazol2yl)5(345trimethoxyphenyl)pyrrolidine23dione
3HYDROXY1(6METHYLBENZOTHIAZOL2YL)4((4METHYLPHENYL)CARBONYL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
514188911
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)C)C5=CC(=C(C(=C5)OC)OC)OC)O
COc1c(OC)cc(cc1OC)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC29H26N2O6Sc1156917(10715)25(32)2324(181320(353)27(375)21(1418)364)31(28(34)26(23)33)29301911816(2)1222(19)3829h6142432H15H3b2523+
MFCD03816240
ZINC000102856940
ZINC000102856942

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Available files

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