Vitas-M small molecule compound
methyl 3-[(5E)-5-(3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Catalog ID
STK858008
SMILES COC(=O)CCN1C(=S)S/C(=C/c2cccc(c2)[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/c1-21-12(17)5-6-15-13(18)11(23-14(15)22)8-9-3-2-4-10(7-9)16(19)20/h2-4,7-8H,5-6H2,1H3/b11-8+InChIKey
DTAGRDPUKVYLOF-DHZHZOJOSA-NSynonyms
303117-33-1(E)methyl3(5(3nitrobenzylidene)4oxo2thioxothiazolidin3yl)propanoate
303117331
COC(=O)CCN1C(=O)C(=CC2=CC(=CC=C2)(N+)(=O)(O))SC1=S
COC(=O)CCN1C(=S)SC(=Cc2cccc(c2)(N+)(=O)(O))C1=O
InChI=1SC14H12N2O5S2c12112(17)561513(18)11(2314(15)22)8932410(79)16(19)20h2478H56H21H3b118+
METHYL3((5E)5((3NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOATE
methyl3((5E)5(3nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoate
METHYL3(5((3NITROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD02332165
ZINC000004482663
ZINC04482663
ZINC4482663
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