Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-phenylpyrrolidine-2,3-dione
Catalog ID
STK568894
SMILES Cc1cc(C)c2c(c1)sc(n2)N1C(c2ccccc2)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=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 C28H22N2O5S MW 498.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O5S/c1-15-12-16(2)23-21(13-15)36-28(29-23)30-24(17-6-4-3-5-7-17)22(26(32)27(30)33)25(31)18-8-9-19-20(14-18)35-11-10-34-19/h3-9,12-14,24,31H,10-11H2,1-2H3/b25-22+InChIKey
UEVSZZODYLOIMM-YYDJUVGSSA-NSynonyms
577697-90-6(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(46dimethyl13benzothiazol2yl)5phenylpyrrolidine23dione
577697906
CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C4=CC5=C(C=C4)OCCO5)O)C(=O)C3=O)C6=CC=CC=C6)C
Cc1cc(C)c2c(c1)sc(n2)N1C(c2ccccc2)C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C1=O
InChI=1SC28H22N2O5Sc1151216(2)2321(1315)3628(2923)3024(176435717)22(26(32)27(30)33)25(31)18891920(1418)3511103419h3912142431H1011H212H3b2522+
MFCD05735295
ZINC000102554831
ZINC000102554838
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