Vitas-M small molecule compound
(5E)-5-(2-butoxybenzylidene)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK703667
SMILES CCCCOc1ccccc1/C=C\1/SC(=S)N(C1=O)C1CCS(=O)(=O)C1
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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 C18H21NO4S3 MW 411.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4S3/c1-2-3-9-23-15-7-5-4-6-13(15)11-16-17(20)19(18(24)25-16)14-8-10-26(21,22)12-14/h4-7,11,14H,2-3,8-10,12H2,1H3/b16-11+InChIKey
KTRBWSIXMFNRTO-LFIBNONCSA-NSynonyms
(5E)5((2butoxyphenyl)methylidene)3(11dioxothiolan3yl)2sulfanylidene13thiazolidin4one
(5E)5(2butoxybenzylidene)3(11dioxidotetrahydrothiophen3yl)2thioxo13thiazolidin4one
(Z)5(2butoxybenzylidene)3(11dioxidotetrahydrothiophen3yl)2thioxothiazolidin4one
CCCCOC1=CC=CC=C1C=C2C(=O)N(C(=S)S2)C3CCS(=O)(=O)C3
CCCCOc1ccccc1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1
InChI=1SC18H21NO4S3c12392315754613(15)111617(20)19(18(24)2516)1481026(2122)1214h471114H2381012H21H3b1611+
MFCD04441838
ZINC000026458805
ZINC000026458808
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