4-[5-(3-cyclopentyloxy-4-methoxy-phenyl)-3-(imidazol-1-ylmethyl)thiophen-2-yl]benzoic acid

Systemtic Name: 4-[5-(3-cyclopentyloxy-4-methoxy-phenyl)-3-(imidazol-1-ylmethyl)thiophen-2-yl]benzoic acid Openeye Name: 4-[5-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-(imidazol-1-ylmethyl)-2-thienyl]benzoic acid CAS Name: 4-[5-(3-cyclopentyloxy-4-methoxyphenyl)-3-(1-imidazolylmethyl)-2-thiophenyl]benzoic acid IUPAC Name: 4-[5-(3-cyclopentyloxy-4-methoxyphenyl)-3-(imidazol-1-ylmethyl)thiophen-2-yl]benzoic acid Traditional Name: 4-[5-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-(imidazol-1-ylmethyl)-2-thienyl]benzoic acid Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C(S2)C3=CC=C(C=C3)C(=O)O)CN4C=CN=C4)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C(S2)C3=CC=C(C=C3)C(=O)O)CN4C=CN=C4)OC5CCCC5

InChI

InChI=1S/C27H26N2O4S/c1-32-23-11-10-20(14-24(23)33-22-4-2-3-5-22)25-15-21(16-29-13-12-28-17-29)26(34-25)18-6-8-19(9-7-18)27(30)31/h6-15,17,22H,2-5,16H2,1H3,(H,30,31)