Vitas-M small molecule compound
(4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK568577
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1cccc(c1)OCCC(C)C
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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 C34H34N2O6S MW 598.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34N2O6S/c1-5-40-25-10-11-26-28(18-25)43-34(35-26)36-30(21-7-6-8-24(17-21)41-14-13-19(2)3)29(32(38)33(36)39)31(37)22-9-12-27-23(16-22)15-20(4)42-27/h6-12,16-20,30,37H,5,13-15H2,1-4H3/b31-29+InChIKey
BFAWFCZXXIBMCL-OWWNRXNESA-NSynonyms
893698-76-5(4E)1(6ethoxy13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3(3methylbutoxy)phenyl)pyrrolidine23dione
893698765
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC5=C(C=C4)OC(C5)C)O)C(=O)C3=O)C6=CC(=CC=C6)OCCC(C)C
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc3c(c2)CC(O3)C)O)C1c1cccc(c1)OCCC(C)C
InChI=1SC34H34N2O6Sc15402510112628(1825)4334(3526)3630(2176824(1721)41141319(2)3)29(32(38)33(36)39)31(37)229122723(1622)1520(4)4227h61216203037H51315H214H3b3129+
MFCD05731002
ZINC000102552956
ZINC000102653151
Check stock
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