Vitas-M small molecule compound
3-methyl-2-{(5Z)-5-[4-(octyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STK546410
SMILES CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(C)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 C23H31NO4S2 MW 449.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31NO4S2/c1-4-5-6-7-8-9-14-28-18-12-10-17(11-13-18)15-19-21(25)24(23(29)30-19)20(16(2)3)22(26)27/h10-13,15-16,20H,4-9,14H2,1-3H3,(H,26,27)/b19-15-InChIKey
HYOUVEWJVPDQFE-CYVLTUHYSA-NSynonyms
(Z)3methyl2(5(4(octyloxy)benzylidene)4oxo2thioxothiazolidin3yl)butanoicacid
3METHYL2((5Z)5((4OCTOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
3methyl2((5Z)5(4(octyloxy)benzylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
3METHYL2(5((4OCTYLOXYPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))BUTANOICACID
CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C(C(C)C)C(=O)O
CCCCCCCCOc1ccc(cc1)C=C1SC(=S)N(C1=O)C(C(=O)O)C(C)C
InChI=1SC23H31NO4S2c1456789142818121017(111318)151921(25)24(23(29)3019)20(16(2)3)22(26)27h1013151620H4914H213H3(H2627)b1915
MFCD03293143
ZINC000100852783
ZINC000100852785
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