ethyl 3-(2-methylpropyl)-5-(2-phenylbutanoylamino)-2-propyl-imidazole-4-carboxylate

Systemtic Name: ethyl 3-(2-methylpropyl)-5-(2-phenylbutanoylamino)-2-propyl-imidazole-4-carboxylate Openeye Name: ethyl 3-isobutyl-5-(2-phenylbutanoylamino)-2-propyl-imidazole-4-carboxylate CAS Name: 3-(2-methylpropyl)-5-[(1-oxo-2-phenylbutyl)amino]-2-propyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-methylpropyl)-5-(2-phenylbutanoylamino)-2-propylimidazole-4-carboxylate Traditional Name: 3-isobutyl-5-(2-phenylbutanoylamino)-2-propyl-imidazole-4-carboxylic acid ethyl ester Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC(C)C)C(=O)OCC)NC(=O)C(CC)C2=CC=CC=C2

Isomeric SMILES

CCCC1=NC(=C(N1CC(C)C)C(=O)OCC)NC(=O)C(CC)C2=CC=CC=C2

InChI

InChI=1S/C23H33N3O3/c1-6-12-19-24-21(20(23(28)29-8-3)26(19)15-16(4)5)25-22(27)18(7-2)17-13-10-9-11-14-17/h9-11,13-14,16,18H,6-8,12,15H2,1-5H3,(H,25,27)