Vitas-M small molecule compound
(4E)-5-(2,3-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL037196
SMILES COc1c(OC)cccc1C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=O)/C/1=C(\c1ccccc1)/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 C27H22N2O6S MW 502.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O6S/c1-33-16-12-13-18-20(14-16)36-27(28-18)29-22(17-10-7-11-19(34-2)25(17)35-3)21(24(31)26(29)32)23(30)15-8-5-4-6-9-15/h4-14,22,30H,1-3H3/b23-21+InChIKey
VIFDUZGCBWRRRP-XTQSDGFTSA-NSynonyms
514186-57-3(4E)5(23dimethoxyphenyl)4(hydroxy(phenyl)methylidene)1(6methoxy13benzothiazol2yl)pyrrolidine23dione
5(23DIMETHOXYPHENYL)3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)4(PHENYLCARBONYL)3PYRROLIN2ONE
514186573
COC1=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
COc1c(OC)cccc1C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=O)C1=C(c1ccccc1)O
InChI=1SC27H22N2O6Sc1331612131820(1416)3627(2818)2922(171071119(342)25(17)353)21(24(31)26(29)32)23(30)158546915h4142230H13H3b2321+
MFCD03802384
ZINC000102857387
ZINC000102857389
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