1-cyclohexyl-2-[(2-phenylphenoxy)methyl]-4-thiophen-2-yl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[(2-phenylphenoxy)methyl]-4-thiophen-2-yl-benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[(2-phenylphenoxy)methyl]-4-(2-thienyl)benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[(2-phenylphenoxy)methyl]-4-thiophen-2-yl-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[(2-phenylphenoxy)methyl]-4-thiophen-2-ylbenzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[(2-phenylphenoxy)methyl]-4-(2-thienyl)benzimidazole-5-carboxylic acid Formula: C31H28N2O3S MolecularWeight: 508.63062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C(=C(C=C3)C(=O)O)C4=CC=CS4)N=C2COC5=CC=CC=C5C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C(=C(C=C3)C(=O)O)C4=CC=CS4)N=C2COC5=CC=CC=C5C6=CC=CC=C6

InChI

InChI=1S/C31H28N2O3S/c34-31(35)24-17-18-25-30(29(24)27-16-9-19-37-27)32-28(33(25)22-12-5-2-6-13-22)20-36-26-15-8-7-14-23(26)21-10-3-1-4-11-21/h1,3-4,7-11,14-19,22H,2,5-6,12-13,20H2,(H,34,35)