4-[(4-cyanophenyl)methyl]-N-(4-fluorophenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-(4-fluorophenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-(4-fluorophenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-(4-fluorophenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-(4-fluorophenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(4-cyanobenzyl)-N-(4-fluorophenyl)-1,4-diazepane-1-carboxamide Formula: C20H21FN4O MolecularWeight: 352.405343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21FN4O/c21-18-6-8-19(9-7-18)23-20(26)25-11-1-10-24(12-13-25)15-17-4-2-16(14-22)3-5-17/h2-9H,1,10-13,15H2,(H,23,26)