Vitas-M small molecule compound
ethyl [(5Z)-5-{3,5-diiodo-4-[(4-nitrobenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK157132
SMILES CCOC(=O)CN1C(=O)S/C(=C\c2cc(I)c(c(c2)I)OCc2ccc(cc2)[N+](=O)[O-])/C1=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 C21H16I2N2O7S MW 694.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16I2N2O7S/c1-2-31-18(26)10-24-20(27)17(33-21(24)28)9-13-7-15(22)19(16(23)8-13)32-11-12-3-5-14(6-4-12)25(29)30/h3-9H,2,10-11H2,1H3/b17-9-InChIKey
KGFRJZHSPIOJDN-MFOYZWKCSA-NSynonyms
CCOC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCC3=CC=C(C=C3)(N+)(=O)(O))I)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2cc(I)c(c(c2)I)OCc2ccc(cc2)(N+)(=O)(O))C1=O
ETHYL((5Z)5(35DIIODO4((4NITROBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5Z)5((35DIIODO4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC21H16I2N2O7Sc123118(26)102420(27)17(3321(24)28)913715(22)19(16(23)813)3211123514(6412)25(29)30h39H21011H21H3b179
MFCD03226796
ZINC000150345328
ZINC150345328
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