Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-5-(5-methylfuran-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK611452
SMILES COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)c1sc2c(n1)c(C)cc(c2)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 C27H24N2O5S MW 488.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O5S/c1-13-10-15(3)22-20(11-13)35-27(28-22)29-23(19-8-6-16(4)34-19)21(25(31)26(29)32)24(30)17-7-9-18(33-5)14(2)12-17/h6-12,23,30H,1-5H3/b24-21+InChIKey
JFEPAEMFIVCECP-DARPEHSRSA-NSynonyms
618419-13-9(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(4methoxy3methylphenyl)methylidene)5(5methylfuran2yl)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)5(5METHYL(2FURYL))3PYRROLIN2ONE
618419139
CC1=CC=C(O1)C2C(=C(C3=CC(=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
COc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(o1)C)c1sc2c(n1)c(C)cc(c2)C)O
InChI=1SC27H24N2O5Sc1131015(3)2220(1113)3527(2822)2923(198616(4)3419)21(25(31)26(29)32)24(30)177918(335)14(2)1217h6122330H15H3b2421+
MFCD08735010
ZINC000102708392
ZINC000102708394
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