ethyl 3-methyl-2-(phenylmethyl)-5-[propyl(propylcarbamoyl)amino]imidazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-2-(phenylmethyl)-5-[propyl(propylcarbamoyl)amino]imidazole-4-carboxylate Openeye Name: ethyl 2-benzyl-3-methyl-5-[propyl(propylcarbamoyl)amino]imidazole-4-carboxylate CAS Name: 3-methyl-5-[[oxo(propylamino)methyl]-propylamino]-2-(phenylmethyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzyl-3-methyl-5-[propyl(propylcarbamoyl)amino]imidazole-4-carboxylate Traditional Name: 2-benzyl-3-methyl-5-[propyl(propylcarbamoyl)amino]imidazole-4-carboxylic acid ethyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N(CCC)C1=C(N(C(=N1)CC2=CC=CC=C2)C)C(=O)OCC

Isomeric SMILES

CCCNC(=O)N(CCC)C1=C(N(C(=N1)CC2=CC=CC=C2)C)C(=O)OCC

InChI

InChI=1S/C21H30N4O3/c1-5-13-22-21(27)25(14-6-2)19-18(20(26)28-7-3)24(4)17(23-19)15-16-11-9-8-10-12-16/h8-12H,5-7,13-15H2,1-4H3,(H,22,27)