Vitas-M small molecule compound
5-{2,5-dimethyl-3-[(E)-{(2Z)-2-[(4-methylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-1H-pyrrol-1-yl}benzene-1,3-dicarboxylic acid
Catalog ID
STK153225
SMILES Cc1ccc(cc1)/N=C\1/NC(=O)/C(=C\c2cc(n(c2C)c2cc(cc(c2)C(=O)O)C(=O)O)C)/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 C25H21N3O5S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5S/c1-13-4-6-19(7-5-13)26-25-27-22(29)21(34-25)12-16-8-14(2)28(15(16)3)20-10-17(23(30)31)9-18(11-20)24(32)33/h4-12H,1-3H3,(H,30,31)(H,32,33)(H,26,27,29)/b21-12+InChIKey
YTMQMZVFGTYLGN-CIAFOILYSA-NSynonyms
5(25DIMETHYL3((E)((2Z)2((4METHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)1HPYRROL1YL)BENZENE13DICARBOXYLICACID
5(25DIMETHYL3((E)(2(4METHYLANILINO)4OXO13THIAZOL5YLIDENE)METHYL)PYRROL1YL)BENZENE13DICARBOXYLICACID
CC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=C(N(C(=C3)C)C4=CC(=CC(=C4)C(=O)O)C(=O)O)C)S2
Cc1ccc(cc1)N=C1NC(=O)C(=Cc2cc(n(c2C)c2cc(cc(c2)C(=O)O)C(=O)O)C)S1
InChI=1SC25H21N3O5Sc1134619(7513)26252722(29)21(3425)1216814(2)28(15(16)3)201017(23(30)31)918(1120)24(32)33h412H13H3(H3031)(H3233)(H262729)b2112+
MFCD03226665
ZINC000009311814
ZINC9311814
Check stock
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Check stock on Vitas-MAvailable files
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