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2-(benzyl)-5-(cyclohexylcarbamoyl-propyl-amino)-3-methyl-imidazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID 8f2n3ZWsaO6
InChI InChI=1S/C24H34N4O3/c1-4-16-28(24(30)25-19-14-10-7-11-15-19)22-21(23(29)31-5-2)27(3)20(26-22)17-18-12-8-6-9-13-18/h6,8-9,12-13,19H,4-5,7,10-11,14-17H2,1-3H3,(H,25,30)
InChIKey JMCUOODUCGIKOZ-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C24H34N4O3
Exact Mass 426.263091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29ltO46KH6x
Name N1-[2-Benzyl-1-methyl-5-ethoxycarbonyl)imidazol-4-yl]-N1-propyl-N2-cyclohexylurea
Alternate Name(s) 5-[[(cyclohexylamino)-oxomethyl]-propylamino]-3-methyl-2-(phenylmethyl)-4-imidazolecarboxylic acid ethyl ester ethyl 2-benzyl-5-[cyclohexylcarbamoyl(propyl)amino]-3-methylimidazole-4-carboxylate ethyl 2-benzyl-5-[cyclohexylcarbamoyl(propyl)amino]-3-methyl-imidazole-4-carboxylate ethyl 5-[cyclohexylcarbamoyl(propyl)amino]-3-methyl-2-(phenylmethyl)imidazole-4-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C24H34N4O3
InChI InChI=1S/C24H34N4O3/c1-4-16-28(24(30)25-19-14-10-7-11-15-19)22-21(23(29)31-5-2)27(3)20(26-22)17-18-12-8-6-9-13-18/h6,8-9,12-13,19H,4-5,7,10-11,14-17H2,1-3H3,(H,25,30)
InChIKey JMCUOODUCGIKOZ-UHFFFAOYSA-N
Molecular Weight 426.561 g/mol
SMILES N(C(N(c1c([n](C)c(n1)Cc1ccccc1)C(=O)OCC)CCC)=O)C1CCCCC1
SPLASH splash10-00di-0090200000-891041eede90055bc4bd
Source of Spectrum E2-50-1380-3
Wiley ID 1555937