N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[1-[(3,4-dichlorophenyl)methyl]-2-benzimidazolyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[1-(3,4-dichlorobenzyl)benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Formula: C27H29Cl2N3O MolecularWeight: 482.44466

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC4=NC5=CC=CC=C5N4CC6=CC(=C(C=C6)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC4=NC5=CC=CC=C5N4CC6=CC(=C(C=C6)Cl)Cl

InChI

InChI=1S/C27H29Cl2N3O/c28-21-6-5-17(12-22(21)29)16-32-24-4-2-1-3-23(24)31-25(32)7-8-30-26(33)27-13-18-9-19(14-27)11-20(10-18)15-27/h1-6,12,18-20H,7-11,13-16H2,(H,30,33)