4-[2-(1H-imidazol-2-yl)-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid

Systemtic Name: 4-[2-(1H-imidazol-2-yl)-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid Openeye Name: 4-[2-(1H-imidazol-2-yl)-5-(3-thienylmethoxy)phenoxy]-4-(o-tolyl)butanoic acid CAS Name: 4-[2-(1H-imidazol-2-yl)-5-(3-thiophenylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid IUPAC Name: 4-[2-(1H-imidazol-2-yl)-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid Traditional Name: 4-[2-(1H-imidazol-2-yl)-5-(3-thenyloxy)phenoxy]-4-(o-tolyl)butyric acid Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)O)OC2=C(C=CC(=C2)OCC3=CSC=C3)C4=NC=CN4

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)O)OC2=C(C=CC(=C2)OCC3=CSC=C3)C4=NC=CN4

InChI

InChI=1S/C25H24N2O4S/c1-17-4-2-3-5-20(17)22(8-9-24(28)29)31-23-14-19(30-15-18-10-13-32-16-18)6-7-21(23)25-26-11-12-27-25/h2-7,10-14,16,22H,8-9,15H2,1H3,(H,26,27)(H,28,29)