Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Catalog ID
STL053336
SMILES CCOc1ccc2c(c1)sc(n2)N1C(c2cccnc2)/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 C27H21N3O6S MW 515.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O6S/c1-2-34-17-6-7-18-21(13-17)37-27(29-18)30-23(16-4-3-9-28-14-16)22(25(32)26(30)33)24(31)15-5-8-19-20(12-15)36-11-10-35-19/h3-9,12-14,23,31H,2,10-11H2,1H3/b24-22+InChIKey
NIHMSFRTXGHCSV-ZNTNEXAZSA-NSynonyms
573934-45-9(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(6ethoxy13benzothiazol2yl)5(pyridin3yl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(6ETHOXY13BENZOTHIAZOL2YL)5PYRIDIN3YLPYRROLIDINE23DIONE
573934459
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC5=C(C=C4)OCCO5)O)C(=O)C3=O)C6=CN=CC=C6
CCOc1ccc2c(c1)sc(n2)N1C(c2cccnc2)C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C1=O
InChI=1SC27H21N3O6Sc123417671821(1317)3727(2918)3023(16439281416)22(25(32)26(30)33)24(31)15581920(1215)3611103519h3912142331H21011H21H3b2422+
MFCD05728125
ZINC000102891439
ZINC000102891443
Check stock
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