Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Catalog ID
STK565606
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)c1nc2c(s1)cc(cc2)C)/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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-15-4-7-17(8-5-15)23-22(24(30)18-9-11-19(33-3)12-10-18)25(31)26(32)29(23)27-28-20-13-6-16(2)14-21(20)34-27/h4-14,23,30H,1-3H3/b24-22+InChIKey
OCOZEASTYQDIPQ-ZNTNEXAZSA-NSynonyms
514189-31-2(4E)4(hydroxy(4methoxyphenyl)methylidene)1(6methyl13benzothiazol2yl)5(4methylphenyl)pyrrolidine23dione
3HYDROXY4((4METHOXYPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)5(4METHYLPHENYL)3PYRROLIN2ONE
514189312
CC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)C
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C)c1nc2c(s1)cc(cc2)C)O
InChI=1SC27H22N2O4Sc1154717(8515)2322(24(30)1891119(333)121018)25(31)26(32)29(23)27282013616(2)1421(20)3427h4142330H13H3b2422+
MFCD03799040
ZINC000102536194
ZINC000102536204
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