Vitas-M small molecule compound
3-{(5Z)-5-[4-(octyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid
Catalog ID
STK542269
SMILES CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=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 C21H27NO4S2 MW 421.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO4S2/c1-2-3-4-5-6-7-14-26-17-10-8-16(9-11-17)15-18-20(25)22(21(27)28-18)13-12-19(23)24/h8-11,15H,2-7,12-14H2,1H3,(H,23,24)/b18-15-InChIKey
KWWIYZLCDIBDQN-SDXDJHTJSA-NSynonyms
488087-61-2(Z)3(5(4(octyloxy)benzylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((4OCTOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5Z)5(4(octyloxy)benzylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
488087612
CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O
CCCCCCCCOc1ccc(cc1)C=C1SC(=S)N(C1=O)CCC(=O)O
InChI=1SC21H27NO4S2c123456714261710816(91117)151820(25)22(21(27)2818)131219(23)24h81115H271214H21H3(H2324)b1815
MFCD03287732
ZINC000100832346
ZINC100832346
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