Vitas-M small molecule compound
2-{(5E)-5-[(8-chloroquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoic acid
Catalog ID
STK628756
SMILES CSCCC(N1C(=S)S/C(=C/c2ccc3c(n2)c(Cl)ccc3)/C1=O)C(=O)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 C18H15ClN2O3S3 MW 438.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O3S3/c1-26-8-7-13(17(23)24)21-16(22)14(27-18(21)25)9-11-6-5-10-3-2-4-12(19)15(10)20-11/h2-6,9,13H,7-8H2,1H3,(H,23,24)/b14-9+InChIKey
LDNSTQMFGXNENZ-NTEUORMPSA-NSynonyms
(E)2(5((8chloroquinolin2yl)methylene)4oxo2thioxothiazolidin3yl)4(methylthio)butanoicacid
2((5E)5((8chloroquinolin2yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)4methylsulfanylbutanoicacid
2((5E)5((8chloroquinolin2yl)methylidene)4oxo2thioxo13thiazolidin3yl)4(methylsulfanyl)butanoicacid
CSCCC(C(=O)O)N1C(=O)C(=CC2=NC3=C(C=CC=C3Cl)C=C2)SC1=S
CSCCC(N1C(=S)SC(=Cc2ccc3c(n2)c(Cl)ccc3)C1=O)C(=O)O
InChI=1SC18H15ClN2O3S3c1268713(17(23)24)2116(22)14(2718(21)25)911651032412(19)15(10)2011h26913H78H21H3(H2324)b149+
MFCD09798547
ZINC000008991152
ZINC000008991153
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