N-(2,6-diethylphenyl)-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-diazepan-1-yl]acetamide Formula: C27H35N5O MolecularWeight: 445.5997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)CC3=CN=C(N3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)CC3=CN=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C27H35N5O/c1-3-21-12-8-13-22(4-2)26(21)30-25(33)20-32-15-9-14-31(16-17-32)19-24-18-28-27(29-24)23-10-6-5-7-11-23/h5-8,10-13,18H,3-4,9,14-17,19-20H2,1-2H3,(H,28,29)(H,30,33)