Vitas-M small molecule compound
(5Z)-5-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-(2-cyclopentylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL368836
SMILES COc1cc(/C=C/2\SC(=S)N(C2=O)CCC2CCCC2)cc(c1O)Cl
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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 C18H20ClNO3S2 MW 397.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO3S2/c1-23-14-9-12(8-13(19)16(14)21)10-15-17(22)20(18(24)25-15)7-6-11-4-2-3-5-11/h8-11,21H,2-7H2,1H3/b15-10-InChIKey
MBXKQVFIFMFSNY-GDNBJRDFSA-NSynonyms
(5Z)5((3CHLORO4HYDROXY5METHOXYPHENYL)METHYLIDENE)3(2CYCLOPENTYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3chloro4hydroxy5methoxybenzylidene)3(2cyclopentylethyl)2thioxo13thiazolidin4one
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC3CCCC3)Cl)O
COc1cc(C=C2SC(=S)N(C2=O)CCC2CCCC2)cc(c1O)Cl
InChI=1SC18H20ClNO3S2c12314912(813(19)16(14)21)101517(22)20(18(24)2515)7611423511h81121H27H21H3b1510
MFCD03713922
ZINC000015011115
ZINC15011115
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