Vitas-M small molecule compound
(4E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STL041180
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1Cl
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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 C34H32ClN3O5S2 MW 662.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32ClN3O5S2/c1-3-4-7-15-42-25-11-8-10-21(18-25)29-28(30(39)22-13-14-27-24(17-22)16-20(2)43-27)31(40)32(41)38(29)33-36-37-34(45-33)44-19-23-9-5-6-12-26(23)35/h5-6,8-14,17-18,20,29,39H,3-4,7,15-16,19H2,1-2H3/b30-28+InChIKey
LAAMMYNYDCEMFW-SJCQXOIGSA-NSynonyms
(4E)1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3(pentyloxy)phenyl)pyrrolidine23dione
(4E)1(5((2CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(3PENTOXYPHENYL)PYRROLIDINE23DIONE
CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC=C6Cl
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1Cl
InChI=1SC34H32ClN3O5S2c13471542251181021(1825)2928(30(39)2213142724(1722)1620(2)4327)31(40)32(41)38(29)33363734(4533)4419239561226(23)35h568141718202939H347151619H212H3b3028+
MFCD05729943
ZINC000150445562
ZINC000150445575
Check stock
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Check stock on Vitas-MAvailable files
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