Vitas-M small molecule compound
(4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-ethoxy-4-propoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK572634
SMILES CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)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 C34H31Cl2N3O6S2 MW 712.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31Cl2N3O6S2/c1-4-12-44-26-11-7-19(15-27(26)43-5-2)29-28(30(40)20-8-10-25-22(14-20)13-18(3)45-25)31(41)32(42)39(29)33-37-38-34(47-33)46-17-21-6-9-23(35)16-24(21)36/h6-11,14-16,18,29,40H,4-5,12-13,17H2,1-3H3/b30-28+InChIKey
UIGXRKOXTLMZAE-SJCQXOIGSA-NSynonyms
897835-78-8(4E)1(5((24dichlorobenzyl)sulfanyl)134thiadiazol2yl)5(3ethoxy4propoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
(4E)1(5((24dichlorophenyl)methylsulfanyl)134thiadiazol2yl)5(3ethoxy4propoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
897835788
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=C(C=C(C=C6)Cl)Cl)OCC
CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)C1=C(c1ccc2c(c1)CC(O2)C)O
InChI=1SC34H31Cl2N3O6S2c1412442611719(1527(26)4352)2928(30(40)208102522(1420)1318(3)4525)31(41)32(42)39(29)33373834(4733)4617216923(35)1624(21)36h6111416182940H45121317H213H3b3028+
MFCD07202269
ZINC000150464420
ZINC000150464435
Check stock
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Check stock on Vitas-MAvailable files
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