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2-(benzyl)-5-(benzylcarbamoyl-propyl-amino)-3-methyl-imidazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID I7EwqbXXCGE
InChI InChI=1S/C25H30N4O3/c1-4-16-29(25(31)26-18-20-14-10-7-11-15-20)23-22(24(30)32-5-2)28(3)21(27-23)17-19-12-8-6-9-13-19/h6-15H,4-5,16-18H2,1-3H3,(H,26,31)
InChIKey JBMDNEDMILRKSU-UHFFFAOYSA-N
Mol Weight 434.54 g/mol
Molecular Formula C25H30N4O3
Exact Mass 434.231791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8boumQa7LhZ
Name N1-[2-Benzyl-1-methyl-5-ethoxycarbonyl)imidazol-4-yl]-N1-propyl-N2-benzylurea
Alternate Name(s) 3-methyl-5-[[oxo-[(phenylmethyl)amino]methyl]-propylamino]-2-(phenylmethyl)-4-imidazolecarboxylic acid ethyl ester ethyl 2-benzyl-5-[benzylcarbamoyl(propyl)amino]-3-methylimidazole-4-carboxylate ethyl 2-benzyl-5-[benzylcarbamoyl(propyl)amino]-3-methyl-imidazole-4-carboxylate ethyl 3-methyl-2-(phenylmethyl)-5-[(phenylmethyl)carbamoyl-propyl-amino]imidazole-4-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C25H30N4O3
InChI InChI=1S/C25H30N4O3/c1-4-16-29(25(31)26-18-20-14-10-7-11-15-20)23-22(24(30)32-5-2)28(3)21(27-23)17-19-12-8-6-9-13-19/h6-15H,4-5,16-18H2,1-3H3,(H,26,31)
InChIKey JBMDNEDMILRKSU-UHFFFAOYSA-N
Molecular Weight 434.540 g/mol
SMILES N(C(N(c1c([n](C)c(n1)Cc1ccccc1)C(=O)OCC)CCC)=O)Cc1ccccc1
SPLASH splash10-00di-0090400000-5396953847ce2e62009a
Source of Spectrum E2-50-1380-3
Wiley ID 1555936