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

Systemtic Name: N-(2-cyanophenyl)-2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2-cyanophenyl)-2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(2-cyanophenyl)-2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: 2-[4-(4-cyanobenzyl)-1,4-diazepan-1-yl]-N-(2-cyanophenyl)acetamide Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)NC2=CC=CC=C2C#N)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN(C1)CC(=O)NC2=CC=CC=C2C#N)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H23N5O/c23-14-18-6-8-19(9-7-18)16-26-10-3-11-27(13-12-26)17-22(28)25-21-5-2-1-4-20(21)15-24/h1-2,4-9H,3,10-13,16-17H2,(H,25,28)