N-[2-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[1-[(2-chloro-6-fluoro-phenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[1-[(2-chloro-6-fluorophenyl)methyl]-2-benzimidazolyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[1-[(2-chloro-6-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[1-(2-chloro-6-fluoro-benzyl)benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Formula: C27H29ClFN3O MolecularWeight: 465.990063

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC4=NC5=CC=CC=C5N4CC6=C(C=CC=C6Cl)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC4=NC5=CC=CC=C5N4CC6=C(C=CC=C6Cl)F

InChI

InChI=1S/C27H29ClFN3O/c28-21-4-3-5-22(29)20(21)16-32-24-7-2-1-6-23(24)31-25(32)8-9-30-26(33)27-13-17-10-18(14-27)12-19(11-17)15-27/h1-7,17-19H,8-16H2,(H,30,33)