Vitas-M small molecule compound
(4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL148866
SMILES COc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\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 C27H22N2O5S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O5S/c1-15-9-11-18-21(13-15)35-27(28-18)29-23(17-10-12-19(33-2)20(14-17)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
GAMSXWJMNNCKEN-ZNTNEXAZSA-NSynonyms
514188-61-5(4E)5(34dimethoxyphenyl)4(hydroxy(phenyl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
5(34DIMETHOXYPHENYL)3HYDROXY1(6METHYLBENZOTHIAZOL2YL)4(PHENYLCARBONYL)3PYRROLIN2ONE
514188615
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=CC=C4)O)C(=O)C3=O)C5=CC(=C(C=C5)OC)OC
COc1ccc(cc1OC)C1C(=C(c2ccccc2)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC27H22N2O5Sc1159111821(1315)3527(2818)2923(17101219(332)20(1417)343)22(25(31)26(29)32)24(30)167546816h4142330H13H3b2422+
MFCD03815588
ZINC000102931926
ZINC000102931928
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