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(4E)-5-(3-butoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione

Catalog ID
STL054758
SMILES CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/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 C37H33N3O5S2 MW 663.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H33N3O5S2/c1-3-4-17-44-28-13-8-11-24(20-28)32-31(33(41)25-15-16-30-27(19-25)18-22(2)45-30)34(42)35(43)40(32)36-38-39-37(47-36)46-21-26-12-7-10-23-9-5-6-14-29(23)26/h5-16,19-20,22,32,41H,3-4,17-18,21H2,1-2H3/b33-31+
InChIKey
GWEAJFAZYLBVED-QOSDPKFLSA-N
Synonyms

(4E)5(3butoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)5(3BUTOXYPHENYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)PYRROLIDINE23DIONE
CCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC7=CC=CC=C76
CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)C1=C(c1ccc2c(c1)CC(O2)C)O
InChI=1SC37H33N3O5S2c1341744281381124(2028)3231(33(41)2515163027(1925)1822(2)4530)34(42)35(43)40(32)36383937(4736)46212612710239561429(23)26h5161920223241H34171821H212H3b3331+
MFCD05733591
ZINC000150463438
ZINC000150463445

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Available files

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