Vitas-M small molecule compound
(5Z)-5-{4-[(2,4-dichlorobenzyl)oxy]-3-methoxy-5-(prop-2-en-1-yl)benzylidene}-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK157155
SMILES C=CCc1cc(/C=C/2\SC(=O)N(C2=O)Cc2cccc(c2)[N+](=O)[O-])cc(c1OCc1ccc(cc1Cl)Cl)OC
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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 C28H22Cl2N2O6S MW 585.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl2N2O6S/c1-3-5-19-10-18(12-24(37-2)26(19)38-16-20-8-9-21(29)14-23(20)30)13-25-27(33)31(28(34)39-25)15-17-6-4-7-22(11-17)32(35)36/h3-4,6-14H,1,5,15-16H2,2H3/b25-13-InChIKey
HBHRQFDPBXGXSK-MXAYSNPKSA-NSynonyms
(5Z)5((4((24DICHLOROPHENYL)METHOXY)3METHOXY5PROP2ENYLPHENYL)METHYLIDENE)3((3NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5Z)5(4((24DICHLOROBENZYL)OXY)3METHOXY5(PROP2EN1YL)BENZYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
C=CCc1cc(C=C2SC(=O)N(C2=O)Cc2cccc(c2)(N+)(=O)(O))cc(c1OCc1ccc(cc1Cl)Cl)OC
COC1=CC(=CC(=C1OCC2=C(C=C(C=C2)Cl)Cl)CC=C)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC28H22Cl2N2O6Sc135191018(1224(372)26(19)3816208921(29)1423(20)30)132527(33)31(28(34)3925)151764722(1117)32(35)36h34614H151516H22H3b2513
MFCD03226927
ZINC000100236688
ZINC100236688
Check stock
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Check stock on Vitas-MAvailable files
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