Vitas-M small molecule compound
(5Z)-3-(2-cyclopentylethyl)-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL368827
SMILES COc1cc(/C=C/2\SC(=S)N(C2=O)CCC2CCCC2)cc(c1O)[N+](=O)[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 C18H20N2O5S2 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O5S2/c1-25-14-9-12(8-13(16(14)21)20(23)24)10-15-17(22)19(18(26)27-15)7-6-11-4-2-3-5-11/h8-11,21H,2-7H2,1H3/b15-10-InChIKey
ZKAQYWGBFQWNGI-GDNBJRDFSA-NSynonyms
(5Z)3(2CYCLOPENTYLETHYL)5((4HYDROXY3METHOXY5NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(2cyclopentylethyl)5(4hydroxy3methoxy5nitrobenzylidene)2thioxo13thiazolidin4one
COC1=CC(=CC(=C1O)(N+)(=O)(O))C=C2C(=O)N(C(=S)S2)CCC3CCCC3
COc1cc(C=C2SC(=S)N(C2=O)CCC2CCCC2)cc(c1O)(N+)(=O)(O)
InChI=1SC18H20N2O5S2c12514912(813(16(14)21)20(23)24)101517(22)19(18(26)2715)7611423511h81121H27H21H3b1510
MFCD03713685
ZINC000015011109
ZINC15011109
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