azepan-1-yl-[1-[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[1-[(2,5-dimethylphenyl)methyl]-2-benzimidazolyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[1-(2,5-dimethylbenzyl)benzimidazol-2-yl]-4-piperidyl]methanone Formula: C28H36N4O MolecularWeight: 444.61164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3N=C2N4CCC(CC4)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3N=C2N4CCC(CC4)C(=O)N5CCCCCC5

InChI

InChI=1S/C28H36N4O/c1-21-11-12-22(2)24(19-21)20-32-26-10-6-5-9-25(26)29-28(32)31-17-13-23(14-18-31)27(33)30-15-7-3-4-8-16-30/h5-6,9-12,19,23H,3-4,7-8,13-18,20H2,1-2H3