2-[1-[(4-chlorophenyl)methyl]-5-fluoranyl-benzimidazol-2-yl]sulfanylpropanoic acid

Systemtic Name: 2-[1-[(4-chlorophenyl)methyl]-5-fluoranyl-benzimidazol-2-yl]sulfanylpropanoic acid Openeye Name: 2-[1-[(4-chlorophenyl)methyl]-5-fluoro-benzimidazol-2-yl]sulfanylpropanoic acid CAS Name: 2-[[1-[(4-chlorophenyl)methyl]-5-fluoro-2-benzimidazolyl]thio]propanoic acid IUPAC Name: 2-[1-[(4-chlorophenyl)methyl]-5-fluorobenzimidazol-2-yl]sulfanylpropanoic acid Traditional Name: 2-[[1-(4-chlorobenzyl)-5-fluoro-benzimidazol-2-yl]thio]propionic acid Formula: C17H14ClFN2O2S MolecularWeight: 364.821663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)F

Isomeric SMILES

CC(C(=O)O)SC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)F

InChI

InChI=1S/C17H14ClFN2O2S/c1-10(16(22)23)24-17-20-14-8-13(19)6-7-15(14)21(17)9-11-2-4-12(18)5-3-11/h2-8,10H,9H2,1H3,(H,22,23)