Vitas-M small molecule compound
2-{(5Z)-5-[4-(octyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}pentanedioic acid
Catalog ID
STL347702
SMILES CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CCC(=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 C23H29NO6S2 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO6S2/c1-2-3-4-5-6-7-14-30-17-10-8-16(9-11-17)15-19-21(27)24(23(31)32-19)18(22(28)29)12-13-20(25)26/h8-11,15,18H,2-7,12-14H2,1H3,(H,25,26)(H,28,29)/b19-15-InChIKey
GEFOEWLASDVSFU-CYVLTUHYSA-NSynonyms
(Z)2(5(4(octyloxy)benzylidene)4oxo2thioxothiazolidin3yl)pentanedioicacid
2((5Z)5((4OCTOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PENTANEDIOICACID
2((5Z)5(4(octyloxy)benzylidene)4oxo2thioxo13thiazolidin3yl)pentanedioicacid
CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C(CCC(=O)O)C(=O)O
CCCCCCCCOc1ccc(cc1)C=C1SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O
InChI=1SC23H29NO6S2c123456714301710816(91117)151921(27)24(23(31)3219)18(22(28)29)121320(25)26h8111518H271214H21H3(H2526)(H2829)b1915
MFCD05683783
ZINC000101196440
ZINC000101196442
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