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

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[(2-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=CC=C1F)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CC=C1F)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

InChI

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