Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL051482
SMILES COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccs1
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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 C25H18N2O6S2 MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O6S2/c1-31-14-5-6-15-19(12-14)35-25(26-15)27-21(18-3-2-10-34-18)20(23(29)24(27)30)22(28)13-4-7-16-17(11-13)33-9-8-32-16/h2-7,10-12,21,28H,8-9H2,1H3/b22-20+InChIKey
UJJDWIUHFKVXDA-LSDHQDQOSA-NSynonyms
573694-09-4(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)5(thiophen2yl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(6METHOXY13BENZOTHIAZOL2YL)5THIOPHEN2YLPYRROLIDINE23DIONE
573694094
COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC5=C(C=C4)OCCO5)O)C(=O)C3=O)C6=CC=CS6
COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1cccs1
InChI=1SC25H18N2O6S2c13114561519(1214)3525(2615)2721(1832103418)20(23(29)24(27)30)22(28)13471617(1113)33983216h2710122128H89H21H3b2220+
MFCD07198549
ZINC000102889209
ZINC000102889211
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