6-[1-(4-methanethioylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid

Systemtic Name: 6-[1-(4-methanethioylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid Openeye Name: 6-[1-(4-methanethioylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid CAS Name: 6-[[1-(4-methanethioylphenyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid IUPAC Name: 6-[1-(4-methanethioylphenyl)-2-phenylbenzimidazol-5-yl]oxyhexanoic acid Traditional Name: 6-[2-phenyl-1-(4-thioformylphenyl)benzimidazol-5-yl]oxyhexanoic acid Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(N2C4=CC=C(C=C4)C=S)C=CC(=C3)OCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(N2C4=CC=C(C=C4)C=S)C=CC(=C3)OCCCCCC(=O)O

InChI

InChI=1S/C26H24N2O3S/c29-25(30)9-5-2-6-16-31-22-14-15-24-23(17-22)27-26(20-7-3-1-4-8-20)28(24)21-12-10-19(18-32)11-13-21/h1,3-4,7-8,10-15,17-18H,2,5-6,9,16H2,(H,29,30)