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

Systemtic Name: N-(4-cyanophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(4-cyanophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(4-cyanophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-(4-cyanophenyl)-2-[4-(4-fluorobenzyl)-1,4-diazepan-1-yl]acetamide Formula: C21H23FN4O MolecularWeight: 366.431923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)NC2=CC=C(C=C2)C#N)CC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN(C1)CC(=O)NC2=CC=C(C=C2)C#N)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN4O/c22-19-6-2-18(3-7-19)15-25-10-1-11-26(13-12-25)16-21(27)24-20-8-4-17(14-23)5-9-20/h2-9H,1,10-13,15-16H2,(H,24,27)