Vitas-M small molecule compound
(5E)-3-(3-chloro-4-fluorophenyl)-5-{3-ethoxy-5-iodo-4-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK320452
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(c(c2)Cl)F)cc(c1OCc1ccc(cc1)[N+](=O)[O-])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 C25H17ClFIN2O5S2 MW 670.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClFIN2O5S2/c1-2-34-21-10-15(9-20(28)23(21)35-13-14-3-5-16(6-4-14)30(32)33)11-22-24(31)29(25(36)37-22)17-7-8-19(27)18(26)12-17/h3-12H,2,13H2,1H3/b22-11+InChIKey
XSLCSKLNGHYMGX-SSDVNMTOSA-NSynonyms
(5E)3(3chloro4fluorophenyl)5((3ethoxy5iodo4((4nitrophenyl)methoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3(3CHLORO4FLUOROPHENYL)5(3ETHOXY5IODO4((4NITROBENZYL)OXY)BENZYLIDENE)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)(N+)(=O)(O)
CCOc1cc(C=C2SC(=S)N(C2=O)c2ccc(c(c2)Cl)F)cc(c1OCc1ccc(cc1)(N+)(=O)(O))I
InChI=1SC25H17ClFIN2O5S2c1234211015(920(28)23(21)3513143516(6414)30(32)33)112224(31)29(25(36)3722)177819(27)18(26)1217h312H213H21H3b2211+
MFCD03614598
ZINC000150389241
ZINC150389241
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