Vitas-M small molecule compound
4-[(5Z)-5-(2-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid
Catalog ID
STK994077
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2ccccc2[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 C14H12N2O5S2 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O5S2/c17-12(18)6-3-7-15-13(19)11(23-14(15)22)8-9-4-1-2-5-10(9)16(20)21/h1-2,4-5,8H,3,6-7H2,(H,17,18)/b11-8-InChIKey
KGSCKRDJVKGYIN-FLIBITNWSA-NSynonyms
4((5Z)5((2NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4((5Z)5(2nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4(5((2NITROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)O)(N+)(=O)(O)
InChI=1SC14H12N2O5S2c1712(18)6371513(19)11(2314(15)22)89412510(9)16(20)21h12458H367H2(H1718)b118
MFCD01827106
OC(=O)CCCN1C(=S)SC(=Cc2ccccc2(N+)(=O)(O))C1=O
ZINC000001916934
ZINC1916934
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