Vitas-M small molecule compound
(5E)-5-{4-[(4-chlorobenzyl)oxy]-3-ethoxy-5-iodobenzylidene}-3-(3-chloro-4-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK320394
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(c(c2)Cl)F)cc(c1OCc1ccc(cc1)Cl)I
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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 C25H17Cl2FINO3S2 MW 660.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17Cl2FINO3S2/c1-2-32-21-10-15(9-20(29)23(21)33-13-14-3-5-16(26)6-4-14)11-22-24(31)30(25(34)35-22)17-7-8-19(28)18(27)12-17/h3-12H,2,13H2,1H3/b22-11+InChIKey
HOUCELNELVNSCH-SSDVNMTOSA-NSynonyms
(5E)3(3chloro4fluorophenyl)5((4((4chlorophenyl)methoxy)3ethoxy5iodophenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)5(4((4CHLOROBENZYL)OXY)3ETHOXY5IODOBENZYLIDENE)3(3CHLORO4FLUOROPHENYL)2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)F)Cl)I)OCC4=CC=C(C=C4)Cl
CCOc1cc(C=C2SC(=S)N(C2=O)c2ccc(c(c2)Cl)F)cc(c1OCc1ccc(cc1)Cl)I
InChI=1SC25H17Cl2FINO3S2c1232211015(920(29)23(21)3313143516(26)6414)112224(31)30(25(34)3522)177819(28)18(27)1217h312H213H21H3b2211+
MFCD05041042
ZINC000097962204
ZINC97962204
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