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Ethyl 2-anilino-4-[(dimethylamino)carbonyl]-5-methyl-1H-imidazol-1-ylcarbamate
SpectraBase Compound ID Ela6uHaa3z5
InChI InChI=1S/C16H21N5O3/c1-5-24-16(23)19-21-11(2)13(14(22)20(3)4)18-15(21)17-12-9-7-6-8-10-12/h6-10H,5H2,1-4H3,(H,17,18)(H,19,23)
InChIKey MCBHSQFXJXCWFZ-UHFFFAOYSA-N
Mol Weight 331.38 g/mol
Molecular Formula C16H21N5O3
Exact Mass 331.16444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GTIRpUdeyY
Name Ethyl 2-anilino-4-[(dimethylamino)carbonyl]-5-methyl-1H-imidazol-1-ylcarbamate
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Formula C16H21N5O3
InChI InChI=1S/C16H21N5O3/c1-5-24-16(23)19-21-11(2)13(14(22)20(3)4)18-15(21)17-12-9-7-6-8-10-12/h6-10H,5H2,1-4H3,(H,17,18)(H,19,23)
InChIKey MCBHSQFXJXCWFZ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301376z
Molecular Weight 331.376 g/mol
SMILES N(C(=O)OCC)[n]1c(c(nc1Nc1ccccc1)C(=O)N(C)C)C
SPLASH splash10-02a9-0934000000-cfb8a8873e9465eae99b
Source of Spectrum J-77-9341-7k
Synonyms Ethyl (4-(dimethylcarbamoyl)-5-methyl-2-(phenylamino)-1H-imidazol-1-yl)carbamate N-[2-anilino-4-[dimethylamino(oxo)methyl]-5-methyl-1-imidazolyl]carbamic acid ethyl ester Ethyl N-[2-anilino-4-(dimethylcarbamoyl)-5-methylimidazol-1-yl]carbamate Ethyl N-[2-anilino-4-(dimethylcarbamoyl)-5-methyl-imidazol-1-yl]carbamate Ethyl N-[4-(dimethylcarbamoyl)-5-methyl-2-phenylazanyl-imidazol-1-yl]carbamate
Wiley ID 1747023