Vitas-M small molecule compound

5-({[(5Z)-5-(3-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetyl}amino)-2-hydroxybenzoic acid

Catalog ID
STK650809
SMILES O=C(CN1C(=O)S/C(=C\c2cccc(c2)F)/C1=O)Nc1ccc(c(c1)C(=O)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 C19H13FN2O6S MW 416.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13FN2O6S/c20-11-3-1-2-10(6-11)7-15-17(25)22(19(28)29-15)9-16(24)21-12-4-5-14(23)13(8-12)18(26)27/h1-8,23H,9H2,(H,21,24)(H,26,27)/b15-7-
InChIKey
ITCDHIVCCIRHQR-CHHVJCJISA-N
Synonyms
902027-31-0
(Z)5(2(5(3fluorobenzylidene)24dioxothiazolidin3yl)acetamido)2hydroxybenzoicacid
5((((5Z)5(3fluorobenzylidene)24dioxo13thiazolidin3yl)acetyl)amino)2hydroxybenzoicacid
5((2((5Z)5((3FLUOROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETYL)AMINO)2HYDROXYBENZOICACID
5(2(5((3FLUOROPHENYL)METHYLENE)24DIOXO(13THIAZOLIDIN3YL))ACETYLAMINO)2HYDROXYBENZOICACID
902027310
C1=CC(=CC(=C1)F)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC(=C(C=C3)O)C(=O)O
InChI=1SC19H13FN2O6Sc201131210(611)71517(25)22(19(28)2915)916(24)21124514(23)13(812)18(26)27h1823H9H2(H2124)(H2627)b157
MFCD06786888
O=C(CN1C(=O)SC(=Cc2cccc(c2)F)C1=O)Nc1ccc(c(c1)C(=O)O)O
ZINC000009253734
ZINC9253734

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.