2-[[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]methyl]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 2-[[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]methyl]-3-thiophen-2-yl-propanoic acid Openeye Name: 2-[[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]methyl]-3-(2-thienyl)propanoic acid CAS Name: 2-[[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]methyl]-3-thiophen-2-ylpropanoic acid IUPAC Name: 2-[[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]methyl]-3-thiophen-2-ylpropanoic acid Traditional Name: 2-[[2-butyl-1-(2-chlorobenzyl)-4-imidazolin-4-yl]methyl]-3-(2-thienyl)propionic acid Formula: C22H27ClN2O2S MolecularWeight: 418.97998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1NC(=CN1CC2=CC=CC=C2Cl)CC(CC3=CC=CS3)C(=O)O

Isomeric SMILES

CCCCC1NC(=CN1CC2=CC=CC=C2Cl)CC(CC3=CC=CS3)C(=O)O

InChI

InChI=1S/C22H27ClN2O2S/c1-2-3-10-21-24-18(12-17(22(26)27)13-19-8-6-11-28-19)15-25(21)14-16-7-4-5-9-20(16)23/h4-9,11,15,17,21,24H,2-3,10,12-14H2,1H3,(H,26,27)