Vitas-M small molecule compound
methyl 6-[(5E)-5-(4-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoate
Catalog ID
STK969720
SMILES COC(=O)CCCCCN1C(=S)S/C(=C/c2ccc(cc2)[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 C17H18N2O5S2 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O5S2/c1-24-15(20)5-3-2-4-10-18-16(21)14(26-17(18)25)11-12-6-8-13(9-7-12)19(22)23/h6-9,11H,2-5,10H2,1H3/b14-11+InChIKey
CFOZMXMGHQGBBF-SDNWHVSQSA-NSynonyms
15788-38-2(E)methyl6(5(4nitrobenzylidene)4oxo2thioxothiazolidin3yl)hexanoate
15788382
COC(=O)CCCCCN1C(=O)C(=CC2=CC=C(C=C2)(N+)(=O)(O))SC1=S
COC(=O)CCCCCN1C(=S)SC(=Cc2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC17H18N2O5S2c12415(20)5324101816(21)14(2617(18)25)11126813(9712)19(22)23h6911H2510H21H3b1411+
METHYL6((5E)5((4NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOATE
methyl6((5E)5(4nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)hexanoate
METHYL6(5((4NITROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)HEXANOATE
MFCD02332813
ZINC000004860761
ZINC04860761
ZINC4860761
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