(E)-3-[2-butyl-3-[[4-(carboxymethyloxy)phenyl]methyl]-1,2-dihydroimidazol-5-yl]-2-(thiophen-2-ylmethyl)prop-2-enoic acid

Systemtic Name: (E)-3-[2-butyl-3-[[4-(carboxymethyloxy)phenyl]methyl]-1,2-dihydroimidazol-5-yl]-2-(thiophen-2-ylmethyl)prop-2-enoic acid Openeye Name: (E)-3-[2-butyl-3-[[4-(carboxymethyloxy)phenyl]methyl]-1,2-dihydroimidazol-5-yl]-2-(2-thienylmethyl)prop-2-enoic acid CAS Name: (E)-3-[2-butyl-3-[[4-(carboxymethyloxy)phenyl]methyl]-1,2-dihydroimidazol-5-yl]-2-(thiophen-2-ylmethyl)-2-propenoic acid IUPAC Name: (E)-3-[2-butyl-3-[[4-(carboxymethyloxy)phenyl]methyl]-1,2-dihydroimidazol-5-yl]-2-(thiophen-2-ylmethyl)prop-2-enoic acid Traditional Name: (E)-3-[2-butyl-1-[4-(carboxymethyloxy)benzyl]-4-imidazolin-4-yl]-2-(2-thenyl)acrylic acid Formula: C24H28N2O5S MolecularWeight: 456.55452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1NC(=CN1CC2=CC=C(C=C2)OCC(=O)O)C=C(CC3=CC=CS3)C(=O)O

Isomeric SMILES

CCCCC1NC(=CN1CC2=CC=C(C=C2)OCC(=O)O)/C=C(\CC3=CC=CS3)/C(=O)O

InChI

InChI=1S/C24H28N2O5S/c1-2-3-6-22-25-19(12-18(24(29)30)13-21-5-4-11-32-21)15-26(22)14-17-7-9-20(10-8-17)31-16-23(27)28/h4-5,7-12,15,22,25H,2-3,6,13-14,16H2,1H3,(H,27,28)(H,29,30)/b18-12+