Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Catalog ID
STK563489
SMILES Cc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)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 C27H22N2O3S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O3S/c1-15-9-11-18(12-10-15)23-21(24(30)19-7-5-4-6-8-19)25(31)26(32)29(23)27-28-22-17(3)13-16(2)14-20(22)33-27/h4-14,23,30H,1-3H3/b24-21+InChIKey
WXGPYZOJSQLIKS-DARPEHSRSA-NSynonyms
514193-39-6(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(phenyl)methylidene)5(4methylphenyl)pyrrolidine23dione
514193396
CC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
Cc1ccc(cc1)C1C(=C(c2ccccc2)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC27H22N2O3Sc11591118(121015)2321(24(30)197546819)25(31)26(32)29(23)27282217(3)1316(2)1420(22)3327h4142330H13H3b2421+
MFCD03800386
ZINC000102520952
ZINC000102520961
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