N-[2-[1-[3-(4-chloranyl-3-methyl-phenoxy)propyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[1-[3-(4-chloranyl-3-methyl-phenoxy)propyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[1-[3-(4-chloro-3-methyl-phenoxy)propyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[1-[3-(4-chloro-3-methylphenoxy)propyl]-2-benzimidazolyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[1-[3-(4-chloro-3-methylphenoxy)propyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[1-[3-(4-chloro-3-methyl-phenoxy)propyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Formula: C30H36ClN3O2 MolecularWeight: 506.07874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCN2C3=CC=CC=C3N=C2CCNC(=O)C45CC6CC(C4)CC(C6)C5)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCN2C3=CC=CC=C3N=C2CCNC(=O)C45CC6CC(C4)CC(C6)C5)Cl

InChI

InChI=1S/C30H36ClN3O2/c1-20-13-24(7-8-25(20)31)36-12-4-11-34-27-6-3-2-5-26(27)33-28(34)9-10-32-29(35)30-17-21-14-22(18-30)16-23(15-21)19-30/h2-3,5-8,13,21-23H,4,9-12,14-19H2,1H3,(H,32,35)