N-[3-(azepan-1-yl)propyl]-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-[(2-fluorobenzyl)-mesyl-amino]benzamide Formula: C24H32FN3O3S MolecularWeight: 461.592583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=CC=C1F)C2=CC=C(C=C2)C(=O)NCCCN3CCCCCC3

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CC=C1F)C2=CC=C(C=C2)C(=O)NCCCN3CCCCCC3

InChI

InChI=1S/C24H32FN3O3S/c1-32(30,31)28(19-21-9-4-5-10-23(21)25)22-13-11-20(12-14-22)24(29)26-15-8-18-27-16-6-2-3-7-17-27/h4-5,9-14H,2-3,6-8,15-19H2,1H3,(H,26,29)