Vitas-M small molecule compound
3-({4-[(Z)-{(2Z)-2-[(4-ethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-methoxyphenoxy}methyl)benzoic acid
Catalog ID
STK157648
SMILES COc1cc(ccc1OCc1cccc(c1)C(=O)O)/C=C/1\S/C(=N\c2ccc(cc2)CC)/NC1=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 C27H24N2O5S MW 488.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O5S/c1-3-17-7-10-21(11-8-17)28-27-29-25(30)24(35-27)15-18-9-12-22(23(14-18)33-2)34-16-19-5-4-6-20(13-19)26(31)32/h4-15H,3,16H2,1-2H3,(H,31,32)(H,28,29,30)/b24-15-InChIKey
YONQFOPEWHLJAW-IWIPYMOSSA-NSynonyms
3((4((Z)((2Z)2((4ETHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
3((4((Z)(2(4ethylanilino)4oxo13thiazol5ylidene)methyl)2methoxyphenoxy)methyl)benzoicacid
CCC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC(=C4)C(=O)O)OC)S2
COc1cc(ccc1OCc1cccc(c1)C(=O)O)C=C1SC(=Nc2ccc(cc2)CC)NC1=O
InChI=1SC27H24N2O5Sc131771021(11817)28272925(30)24(3527)151891222(23(1418)332)34161954620(1319)26(31)32h415H316H212H3(H3132)(H282930)b2415
MFCD05041088
ZINC000014008614
ZINC14008614
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