Vitas-M small molecule compound

2-hydroxy-5-[(5E)-5-(4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid

Catalog ID
STL035728
SMILES COc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)c1ccc(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 C18H13NO5S2 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13NO5S2/c1-24-12-5-2-10(3-6-12)8-15-16(21)19(18(25)26-15)11-4-7-14(20)13(9-11)17(22)23/h2-9,20H,1H3,(H,22,23)/b15-8+
InChIKey
NGBAEILFTMJJAC-OVCLIPMQSA-N
Synonyms

2hydroxy5((5E)5((4methoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)benzoicacid
2hydroxy5((5E)5(4methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)benzoicacid
COC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)O)C(=O)O
COc1ccc(cc1)C=C1SC(=S)N(C1=O)c1ccc(c(c1)C(=O)O)O
InChI=1SC18H13NO5S2c124125210(3612)81516(21)19(18(25)2615)114714(20)13(911)17(22)23h2920H1H3(H2223)b158+
MFCD18192128
ZINC000032707955
ZINC32707955

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Available files

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