Vitas-M small molecule compound
(4E)-5-(3-ethoxyphenyl)-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
STL042671
SMILES CCOc1cccc(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 C35H29N3O5S2 MW 635.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29N3O5S2/c1-3-42-26-12-7-10-22(18-26)30-29(31(39)23-14-15-28-25(17-23)16-20(2)43-28)32(40)33(41)38(30)34-36-37-35(45-34)44-19-24-11-6-9-21-8-4-5-13-27(21)24/h4-15,17-18,20,30,39H,3,16,19H2,1-2H3/b31-29+InChIKey
OTHZNQOVQVMABW-OWWNRXNESA-NSynonyms
(4E)5(3ethoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)5(3ETHOXYPHENYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)PYRROLIDINE23DIONE
CCOC1=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
CCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)C1=C(c1ccc2c(c1)CC(O2)C)O
InChI=1SC35H29N3O5S2c1342261271022(1826)3029(31(39)2314152825(1723)1620(2)4328)32(40)33(41)38(30)34363735(4534)4419241169218451327(21)24h4151718203039H31619H212H3b3129+
MFCD05736328
ZINC000150445477
ZINC000150445492
Check stock
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Check stock on Vitas-MAvailable files
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