2-fluoranyl-N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 2-fluoranyl-N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-fluoro-N-[2-oxo-2-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide CAS Name: 2-fluoro-N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]benzamide IUPAC Name: 2-fluoro-N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]benzamide Traditional Name: 2-fluoro-N-[2-keto-2-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]ethyl]benzamide Formula: C22H26FN3O2 MolecularWeight: 383.459143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H26FN3O2/c1-17-7-9-18(10-8-17)16-25-11-4-12-26(14-13-25)21(27)15-24-22(28)19-5-2-3-6-20(19)23/h2-3,5-10H,4,11-16H2,1H3,(H,24,28)