Vitas-M small molecule compound
(5Z)-3-ethyl-5-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK449517
SMILES CCN1C(=S)S/C(=C\c2ccc(c(c2)COc2ccc(c(c2)C)[N+](=O)[O-])OC)/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 C21H20N2O5S2 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5S2/c1-4-22-20(24)19(30-21(22)29)11-14-5-8-18(27-3)15(10-14)12-28-16-6-7-17(23(25)26)13(2)9-16/h5-11H,4,12H2,1-3H3/b19-11-InChIKey
OIGUANJHOKIWMW-ODLFYWEKSA-NSynonyms
(5Z)3ETHYL5((4METHOXY3((3METHYL4NITROPHENOXY)METHYL)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3ethyl5(4methoxy3((3methyl4nitrophenoxy)methyl)benzylidene)2thioxo13thiazolidin4one
3ETHYL5((4METHOXY3((3METHYL4NITROPHENOXY)METHYL)PHENYL)METHYLENE)2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CC(=C(C=C2)OC)COC3=CC(=C(C=C3)(N+)(=O)(O))C)SC1=S
CCN1C(=S)SC(=Cc2ccc(c(c2)COc2ccc(c(c2)C)(N+)(=O)(O))OC)C1=O
InChI=1SC21H20N2O5S2c142220(24)19(3021(22)29)11145818(273)15(1014)1228166717(23(25)26)13(2)916h511H412H213H3b1911
MFCD03467402
ZINC000002771991
ZINC02771991
ZINC2771991
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