Vitas-M small molecule compound
{2-chloro-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetonitrile
Catalog ID
STL364698
SMILES N#CCOc1ccc(cc1Cl)/C=C\1/SC(=S)N(C1=O)C
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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 C13H9ClN2O2S2 MW 324.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9ClN2O2S2/c1-16-12(17)11(20-13(16)19)7-8-2-3-10(9(14)6-8)18-5-4-15/h2-3,6-7H,5H2,1H3/b11-7+InChIKey
DUQIIYAGDDNASI-YRNVUSSQSA-NSynonyms
(2chloro4((E)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenoxy)acetonitrile
2(2chloro4((E)(3methyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)acetonitrile
CN1C(=O)C(=CC2=CC(=C(C=C2)OCC#N)Cl)SC1=S
InChI=1SC13H9ClN2O2S2c11612(17)11(2013(16)19)782310(9(14)68)185415h2367H5H21H3b117+
MFCD09475922
N#CCOc1ccc(cc1Cl)C=C1SC(=S)N(C1=O)C
ZINC000009236606
ZINC09236606
ZINC9236606
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