1-(azepan-1-yl)-3-[2-[(4-propan-2-ylphenoxy)methyl]benzimidazol-1-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[2-[(4-propan-2-ylphenoxy)methyl]benzimidazol-1-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[2-[(4-isopropylphenoxy)methyl]benzimidazol-1-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[2-[(4-propan-2-ylphenoxy)methyl]-1-benzimidazolyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[2-[(4-propan-2-ylphenoxy)methyl]benzimidazol-1-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[2-[(4-isopropylphenoxy)methyl]benzimidazol-1-yl]propan-1-one Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4

InChI

InChI=1S/C26H33N3O2/c1-20(2)21-11-13-22(14-12-21)31-19-25-27-23-9-5-6-10-24(23)29(25)18-15-26(30)28-16-7-3-4-8-17-28/h5-6,9-14,20H,3-4,7-8,15-19H2,1-2H3