N-[2-[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[1-[2-(3-methylphenoxy)ethyl]-2-benzimidazolyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Formula: C29H35N3O2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3N=C2CCNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3N=C2CCNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H35N3O2/c1-20-5-4-6-24(13-20)34-12-11-32-26-8-3-2-7-25(26)31-27(32)9-10-30-28(33)29-17-21-14-22(18-29)16-23(15-21)19-29/h2-8,13,21-23H,9-12,14-19H2,1H3,(H,30,33)