Vitas-M small molecule compound

2-({[(5Z)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)benzoic acid

Catalog ID
STK994674
SMILES COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)Nc1ccccc1C(=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 C20H16N2O5S2 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O5S2/c1-27-13-6-4-5-12(9-13)10-16-18(24)22(20(28)29-16)11-17(23)21-15-8-3-2-7-14(15)19(25)26/h2-10H,11H2,1H3,(H,21,23)(H,25,26)/b16-10-
InChIKey
LGHVMFUCAOULIU-YBEGLDIGSA-N
Synonyms

2((((5Z)5(3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetyl)amino)benzoicacid
2((2((5Z)5((3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETYL)AMINO)BENZOICACID
COC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NC3=CC=CC=C3C(=O)O
COc1cccc(c1)C=C1SC(=S)N(C1=O)CC(=O)Nc1ccccc1C(=O)O
InChI=1SC20H16N2O5S2c1271364512(913)101618(24)22(20(28)2916)1117(23)2115832714(15)19(25)26h210H11H21H3(H2123)(H2526)b1610
MFCD03226147
ZINC000028464741
ZINC28464741

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Available files

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