Vitas-M small molecule compound

5-({(E)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-2-hydroxybenzoic acid

Catalog ID
STK553400
SMILES N#C/C(=C\Nc1ccc(c(c1)C(=O)O)O)/c1scc(n1)c1ccc(cc1)[N+](=O)[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 C19H12N4O5S MW 408.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N4O5S/c20-8-12(9-21-13-3-6-17(24)15(7-13)19(25)26)18-22-16(10-29-18)11-1-4-14(5-2-11)23(27)28/h1-7,9-10,21,24H,(H,25,26)/b12-9+
InChIKey
MQJHIQCVHBGPTL-FMIVXFBMSA-N
Synonyms
377052-17-0
(E)5((2cyano2(4(4nitrophenyl)thiazol2yl)vinyl)amino)2hydroxybenzoicacid
377052170
5(((E)2cyano2(4(4nitrophenyl)13thiazol2yl)ethenyl)amino)2hydroxybenzoicacid
C1=CC(=CC=C1C2=CSC(=N2)C(=CNC3=CC(=C(C=C3)O)C(=O)O)C#N)(N+)(=O)(O)
InChI=1SC19H12N4O5Sc20812(921133617(24)15(713)19(25)26)182216(102918)111414(5211)23(27)28h179102124H(H2526)b129+
MFCD02983249
N#CC(=CNc1ccc(c(c1)C(=O)O)O)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000002223705
ZINC2223705

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Available files

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