Vitas-M small molecule compound
4-[(4-{(E)-[2-(acetylamino)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}-2-chlorophenoxy)methyl]benzoic acid
Catalog ID
STK110989
SMILES CC(=O)NC1=NC(=O)/C(=C\c2ccc(c(c2)Cl)OCc2ccc(cc2)C(=O)O)/S1
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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 C20H15ClN2O5S MW 430.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O5S/c1-11(24)22-20-23-18(25)17(29-20)9-13-4-7-16(15(21)8-13)28-10-12-2-5-14(6-3-12)19(26)27/h2-9H,10H2,1H3,(H,26,27)(H,22,23,24,25)/b17-9+InChIKey
XJPZEMJNWVSRSE-RQZCQDPDSA-NSynonyms
4((4((E)(2(ACETYLAMINO)4OXO13THIAZOL5(4H)YLIDENE)METHYL)2CHLOROPHENOXY)METHYL)BENZOICACID
4((4((E)(2ACETAMIDO4OXO13THIAZOL5YLIDENE)METHYL)2CHLOROPHENOXY)METHYL)BENZOICACID
CC(=O)NC1=NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)Cl)S1
CC(=O)NC1=NC(=O)C(=Cc2ccc(c(c2)Cl)OCc2ccc(cc2)C(=O)O)S1
InChI=1SC20H15ClN2O5Sc111(24)22202318(25)17(2920)9134716(15(21)813)2810122514(6312)19(26)27h29H10H21H3(H2627)(H22232425)b179+
MFCD04127493
ZINC000009763252
ZINC9763252
Check stock
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