N-[2-[1-[4-(2-propan-2-ylphenoxy)butyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[1-[4-(2-propan-2-ylphenoxy)butyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[1-[4-(2-isopropylphenoxy)butyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[1-[4-(2-propan-2-ylphenoxy)butyl]-2-benzimidazolyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[1-[4-(2-propan-2-ylphenoxy)butyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[1-[4-(2-isopropylphenoxy)butyl]benzimidazol-2-yl]ethyl]adamantane-1-carboxamide Formula: C33H43N3O2 MolecularWeight: 513.71342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCCCCN2C3=CC=CC=C3N=C2CCNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(C)C1=CC=CC=C1OCCCCN2C3=CC=CC=C3N=C2CCNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C33H43N3O2/c1-23(2)27-9-3-6-12-30(27)38-16-8-7-15-36-29-11-5-4-10-28(29)35-31(36)13-14-34-32(37)33-20-24-17-25(21-33)19-26(18-24)22-33/h3-6,9-12,23-26H,7-8,13-22H2,1-2H3,(H,34,37)