Vitas-M small molecule compound
5-({4-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)-2-hydroxybenzoic acid
Catalog ID
STL036189
SMILES O=C(Nc1ccc(c(c1)C(=O)O)O)CCCN1C(=S)S/C(=C\c2ccccc2F)/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 C21H17FN2O5S2 MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O5S2/c22-15-5-2-1-4-12(15)10-17-19(27)24(21(30)31-17)9-3-6-18(26)23-13-7-8-16(25)14(11-13)20(28)29/h1-2,4-5,7-8,10-11,25H,3,6,9H2,(H,23,26)(H,28,29)/b17-10-InChIKey
NURWZFKBXVAOQE-YVLHZVERSA-NSynonyms
5((4((5Z)5(2fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)butanoyl)amino)2hydroxybenzoicacid
5(4((5Z)5((2fluorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)butanoylamino)2hydroxybenzoicacid
5(4(5((2FLUOROPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))BUTANOYLAMINO)2HYDROXYBENZOICACID
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC(=C(C=C3)O)C(=O)O)F
InChI=1SC21H17FN2O5S2c2215521412(15)101719(27)24(21(30)3117)93618(26)23137816(25)14(1113)20(28)29h124578101125H369H2(H2326)(H2829)b1710
MFCD18192361
O=C(Nc1ccc(c(c1)C(=O)O)O)CCCN1C(=S)SC(=Cc2ccccc2F)C1=O
ZINC000054360660
ZINC54360660
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