Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-methoxy-4-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STL042503
SMILES COc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
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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 C32H29ClN2O7S MW 621.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29ClN2O7S/c1-17(2)10-11-40-22-8-4-18(14-24(22)39-3)28-27(29(36)19-5-9-23-25(15-19)42-13-12-41-23)30(37)31(38)35(28)32-34-21-7-6-20(33)16-26(21)43-32/h4-9,14-17,28,36H,10-13H2,1-3H3/b29-27+InChIKey
STOMUVWZYIMEEC-ORIPQNMZSA-NSynonyms
618858-28-9(4E)1(6chloro13benzothiazol2yl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(3methoxy4(3methylbutoxy)phenyl)pyrrolidine23dione
618858289
CC(C)CCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)Cl)OC
COc1cc(ccc1OCCC(C)C)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
InChI=1SC32H29ClN2O7Sc117(2)101140228418(1424(22)393)2827(29(36)19592325(1519)4213124123)30(37)31(38)35(28)3234217620(33)1626(21)4332h4914172836H1013H213H3b2927+
MFCD05736535
ZINC000102870098
ZINC000102870100
Check stock
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