Vitas-M small molecule compound
[(5Z)-5-{3-bromo-4-[(3,4-dichlorobenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL428634
SMILES OC(=O)CN1C(=S)S/C(=C\c2ccc(c(c2)Br)OCc2ccc(c(c2)Cl)Cl)/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 C19H12BrCl2NO4S2 MW 533.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12BrCl2NO4S2/c20-12-5-10(7-16-18(26)23(8-17(24)25)19(28)29-16)2-4-15(12)27-9-11-1-3-13(21)14(22)6-11/h1-7H,8-9H2,(H,24,25)/b16-7-InChIKey
DKUPVPZBRAEKPM-APSNUPSMSA-NSynonyms
((5Z)5(3bromo4((34dichlorobenzyl)oxy)benzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((3bromo4((34dichlorophenyl)methoxy)phenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
C1=CC(=C(C=C1COC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O)Br)Cl)Cl
InChI=1SC19H12BrCl2NO4S2c2012510(71618(26)23(817(24)25)19(28)2916)2415(12)279111313(21)14(22)611h17H89H2(H2425)b167
MFCD30710625
OC(=O)CN1C(=S)SC(=Cc2ccc(c(c2)Br)OCc2ccc(c(c2)Cl)Cl)C1=O
ZINC000108720572
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