Vitas-M small molecule compound
3-[(5E)-5-(5-bromo-2-butoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK139702
SMILES CCCCOc1ccc(cc1/C=C\1/SC(=S)N(C1=O)CCC(=O)O)Br
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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 C17H18BrNO4S2 MW 444.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18BrNO4S2/c1-2-3-8-23-13-5-4-12(18)9-11(13)10-14-16(22)19(17(24)25-14)7-6-15(20)21/h4-5,9-10H,2-3,6-8H2,1H3,(H,20,21)/b14-10+InChIKey
FCZLKGMTVPNUSR-GXDHUFHOSA-NSynonyms
3((5E)5((5BROMO2BUTOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5E)5(5BROMO2BUTOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
CCCCOC1=C(C=C(C=C1)Br)C=C2C(=O)N(C(=S)S2)CCC(=O)O
CCCCOc1ccc(cc1C=C1SC(=S)N(C1=O)CCC(=O)O)Br
InChI=1SC17H18BrNO4S2c123823135412(18)911(13)101416(22)19(17(24)2514)7615(20)21h45910H2368H21H3(H2021)b1410+
MFCD03994280
ZINC000013880021
ZINC13880021
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