Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-(3-chlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL053429
SMILES Clc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/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 C26H16Cl2N2O5S MW 539.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16Cl2N2O5S/c27-15-3-1-2-13(10-15)22-21(23(31)14-4-7-18-19(11-14)35-9-8-34-18)24(32)25(33)30(22)26-29-17-6-5-16(28)12-20(17)36-26/h1-7,10-12,22,31H,8-9H2/b23-21+InChIKey
SJBLOZWZIUCVCX-XTQSDGFTSA-NSynonyms
577962-66-4(4E)1(6chloro13benzothiazol2yl)5(3chlorophenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
577962664
C1COC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)Cl)C6=CC(=CC=C6)Cl)O
Clc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
InChI=1SC26H16Cl2N2O5Sc271531213(1015)2221(23(31)14471819(1114)35983418)24(32)25(33)30(22)2629176516(28)1220(17)3626h1710122231H89H2b2321+
MFCD05726565
ZINC000102891278
ZINC000102891279
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