Vitas-M small molecule compound
ethyl (2E)-cyano(2-{4-[(2-methylphenyl)carbamoyl]-1H-imidazol-5-yl}hydrazinylidene)ethanoate
Catalog ID
STL445780
SMILES CCOC(=O)/C(=N/Nc1[nH]cnc1C(=O)Nc1ccccc1C)/C#N
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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 C16H16N6O3 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O3/c1-3-25-16(24)12(8-17)21-22-14-13(18-9-19-14)15(23)20-11-7-5-4-6-10(11)2/h4-7,9,22H,3H2,1-2H3,(H,18,19)(H,20,23)/b21-12+InChIKey
XXMBRDXDJGOFAX-CIAFOILYSA-NSynonyms
CCOC(=O)C(=NNc1(nH)cnc1C(=O)Nc1ccccc1C)C#N
CCOC(=O)C(=NNC1=C(NC=N1)C(=O)NC2=CC=CC=C2C)C#N
ethyl(2E)2cyano2((5((2methylphenyl)carbamoyl)1Himidazol4yl)hydrazinylidene)acetate
ethyl(2E)cyano(2(4((2methylphenyl)carbamoyl)1Himidazol5yl)hydrazinylidene)ethanoate
InChI=1SC16H16N6O3c132516(24)12(817)21221413(1891914)15(23)2011754610(11)2h47922H3H212H3(H1819)(H2023)b2112+
MFCD30712899
ZINC000005488822
ZINC33304499
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