Vitas-M small molecule compound
2-chloro-5-{5-[(E)-{2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]hydrazinylidene}methyl]furan-2-yl}benzoic acid
Catalog ID
STL294826
SMILES COCc1cc(C)nc(c1C#N)N/N=C/c1ccc(o1)c1ccc(c(c1)C(=O)O)Cl
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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 C21H17ClN4O4 MW 424.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O4/c1-12-7-14(11-29-2)17(9-23)20(25-12)26-24-10-15-4-6-19(30-15)13-3-5-18(22)16(8-13)21(27)28/h3-8,10H,11H2,1-2H3,(H,25,26)(H,27,28)/b24-10+InChIKey
IUEPTURERJZYEF-YSURURNPSA-NSynonyms
2chloro5(5((E)((3cyano4(methoxymethyl)6methylpyridin2yl)hydrazinylidene)methyl)furan2yl)benzoicacid
2chloro5(5((E)(2(3cyano4(methoxymethyl)6methylpyridin2yl)hydrazinylidene)methyl)furan2yl)benzoicacid
CC1=NC(=C(C(=C1)COC)C#N)NN=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O
COCc1cc(C)nc(c1C#N)NN=Cc1ccc(o1)c1ccc(c(c1)C(=O)O)Cl
InChI=1SC21H17ClN4O4c112714(11292)17(923)20(2512)262410154619(3015)133518(22)16(813)21(27)28h3810H11H212H3(H2526)(H2728)b2410+
MFCD01249872
ZINC000016267799
ZINC16267796
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