Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[(4-chlorobenzyl)oxy]-5-ethoxybenzylidene}-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL378982
SMILES CCOc1cc(/C=C/2\SC(=O)N(C2=O)Cc2ccccc2[N+](=O)[O-])cc(c1OCc1ccc(cc1)Cl)Cl
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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 C26H20Cl2N2O6S MW 559.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2N2O6S/c1-2-35-22-12-17(11-20(28)24(22)36-15-16-7-9-19(27)10-8-16)13-23-25(31)29(26(32)37-23)14-18-5-3-4-6-21(18)30(33)34/h3-13H,2,14-15H2,1H3/b23-13-InChIKey
GTSSGDKGHZKVES-QRVIBDJDSA-NSynonyms
(5Z)5((3chloro4((4chlorophenyl)methoxy)5ethoxyphenyl)methylidene)3((2nitrophenyl)methyl)13thiazolidine24dione
(5Z)5(3chloro4((4chlorobenzyl)oxy)5ethoxybenzylidene)3(2nitrobenzyl)13thiazolidine24dione
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3(N+)(=O)(O))Cl)OCC4=CC=C(C=C4)Cl
CCOc1cc(C=C2SC(=O)N(C2=O)Cc2ccccc2(N+)(=O)(O))cc(c1OCc1ccc(cc1)Cl)Cl
InChI=1SC26H20Cl2N2O6Sc1235221217(1120(28)24(22)3615167919(27)10816)132325(31)29(26(32)3723)1418534621(18)30(33)34h313H21415H21H3b2313
MFCD28951010
ZINC000105403796
ZINC105403796
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