Vitas-M small molecule compound

4-[(5Z)-5-(2-hydroxy-5-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid

Catalog ID
STK993994
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2cc(ccc2O)[N+](=O)[O-])/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 C14H12N2O6S2 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O6S2/c17-10-4-3-9(16(21)22)6-8(10)7-11-13(20)15(14(23)24-11)5-1-2-12(18)19/h3-4,6-7,17H,1-2,5H2,(H,18,19)/b11-7-
InChIKey
DUVGVROSFWRBSZ-XFFZJAGNSA-N
Synonyms

4((5Z)5((2HYDROXY5NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4((5Z)5(2hydroxy5nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4(5((2HYDROXY5NITROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
C1=CC(=C(C=C1(N+)(=O)(O))C=C2C(=O)N(C(=S)S2)CCCC(=O)O)O
InChI=1SC14H12N2O6S2c1710439(16(21)22)68(10)71113(20)15(14(23)2411)51212(18)19h346717H125H2(H1819)b117
MFCD00703721
OC(=O)CCCN1C(=S)SC(=Cc2cc(ccc2O)(N+)(=O)(O))C1=O
ZINC000018141027
ZINC18141027

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Available files

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