1-(azepan-1-yl)-2-[2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]benzimidazol-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]benzimidazol-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzimidazol-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1-benzimidazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-[(5-methyl-2-propan-2-ylphenoxy)methyl]benzimidazol-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzimidazol-1-yl]ethanone Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4

InChI

InChI=1S/C26H33N3O2/c1-19(2)21-13-12-20(3)16-24(21)31-18-25-27-22-10-6-7-11-23(22)29(25)17-26(30)28-14-8-4-5-9-15-28/h6-7,10-13,16,19H,4-5,8-9,14-15,17-18H2,1-3H3