2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[4-(4-cyanobenzyl)-1,4-diazepan-1-yl]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C24H30N4O MolecularWeight: 390.5212

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CN2CCCN(CC2)CC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN2CCCN(CC2)CC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C24H30N4O/c1-3-22-7-4-6-19(2)24(22)26-23(29)18-28-13-5-12-27(14-15-28)17-21-10-8-20(16-25)9-11-21/h4,6-11H,3,5,12-15,17-18H2,1-2H3,(H,26,29)