N-(3-bromophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(3-bromophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(3-bromophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(3-bromophenyl)-2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-(3-bromophenyl)-2-[4-(4-fluorobenzyl)-1,4-diazepan-1-yl]acetamide Formula: C20H23BrFN3O MolecularWeight: 420.318523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrFN3O/c21-17-3-1-4-19(13-17)23-20(26)15-25-10-2-9-24(11-12-25)14-16-5-7-18(22)8-6-16/h1,3-8,13H,2,9-12,14-15H2,(H,23,26)