Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-methoxy-4-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK570872
SMILES COc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\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 C33H31ClN2O6S MW 619.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31ClN2O6S/c1-17(2)11-12-41-25-10-5-19(15-26(25)40-4)29-28(30(37)20-6-9-24-21(14-20)13-18(3)42-24)31(38)32(39)36(29)33-35-23-8-7-22(34)16-27(23)43-33/h5-10,14-18,29,37H,11-13H2,1-4H3/b30-28+InChIKey
PJNJRJMWNLPGHS-SJCQXOIGSA-NSynonyms
(4E)1(6chloro13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3methoxy4(3methylbutoxy)phenyl)pyrrolidine23dione
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)Cl)C6=CC(=C(C=C6)OCCC(C)C)OC)O
COc1cc(ccc1OCCC(C)C)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
InChI=1SC33H31ClN2O6Sc117(2)1112412510519(1526(25)404)2928(30(37)20692421(1420)1318(3)4224)31(38)32(39)36(29)3335238722(34)1627(23)4333h51014182937H1113H214H3b3028+
MFCD05728353
ZINC000102564579
ZINC000102655893
Check stock
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