N-[2-(azepan-1-ylcarbonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonyl-amino]benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonyl-amino]benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonyl-amino]benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonylamino]benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonylamino]benzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[(4-fluorobenzyl)-mesyl-amino]benzamide Formula: C28H30FN3O4S MolecularWeight: 523.618903

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)F)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)F)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

InChI

InChI=1S/C28H30FN3O4S/c1-37(35,36)32(20-21-10-14-23(29)15-11-21)24-16-12-22(13-17-24)27(33)30-26-9-5-4-8-25(26)28(34)31-18-6-2-3-7-19-31/h4-5,8-17H,2-3,6-7,18-20H2,1H3,(H,30,33)