Vitas-M small molecule compound
(4E)-5-(2,5-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL046727
SMILES COc1ccc(cc1C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)/C/1=C(\c1ccccc1)/O)OC
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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 C27H22N2O5S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O5S/c1-15-9-11-19-21(13-15)35-27(28-19)29-23(18-14-17(33-2)10-12-20(18)34-3)22(25(31)26(29)32)24(30)16-7-5-4-6-8-16/h4-14,23,30H,1-3H3/b24-22+InChIKey
NLAWSVOVSWVEDD-ZNTNEXAZSA-NSynonyms
514188-62-6(4E)5(25dimethoxyphenyl)4(hydroxy(phenyl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
5(25DIMETHOXYPHENYL)3HYDROXY1(6METHYLBENZOTHIAZOL2YL)4(PHENYLCARBONYL)3PYRROLIN2ONE
514188626
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=CC=C4)O)C(=O)C3=O)C5=C(C=CC(=C5)OC)OC
COc1ccc(cc1C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)C1=C(c1ccccc1)O)OC
InChI=1SC27H22N2O5Sc1159111921(1315)3527(2819)2923(181417(332)101220(18)343)22(25(31)26(29)32)24(30)167546816h4142330H13H3b2422+
MFCD03809022
ZINC000102884266
ZINC000102884269
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