Vitas-M small molecule compound
5-{[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-3-ium-2-yl)ethenyl]amino}-2-hydroxybenzoate
Catalog ID
STL054355
SMILES N#C/C(=C\Nc1ccc(c(c1)C(=O)[O-])O)/c1scc([nH+]1)c1ccccc1
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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 C19H13N3O3S MW 363.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O3S/c20-9-13(10-21-14-6-7-17(23)15(8-14)19(24)25)18-22-16(11-26-18)12-4-2-1-3-5-12/h1-8,10-11,21,23H,(H,24,25)/b13-10+InChIKey
PQKZOESDFGUTSR-JLHYYAGUSA-NSynonyms
377063-41-7377063417
5(((E)2CYANO2(4PHENYL13THIAZOL2YL)ETHENYL)AMINO)2HYDROXYBENZOICACID
5(((E)2cyano2(4phenyl13thiazol3ium2yl)ethenyl)amino)2hydroxybenzoate
C1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC(=C(C=C3)O)C(=O)O)C#N
InChI=1SC19H13N3O3Sc20913(1021146717(23)15(814)19(24)25)182216(112618)124213512h1810112123H(H2425)b1310+
MFCD02983790
N#CC(=CNc1ccc(c(c1)C(=O)(O))O)c1scc((nH+)1)c1ccccc1
ZINC000001890012
ZINC1890012
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