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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonyl-amino]benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonyl-amino]benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonylamino]benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(4-fluorophenyl)methyl-methylsulfonylamino]benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(4-fluorobenzyl)-mesyl-amino]benzamide Formula: C27H30FN3O5S2 MolecularWeight: 559.672603

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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=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)F)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H30FN3O5S2/c1-37(33,34)31(20-21-6-10-23(28)11-7-21)25-14-8-22(9-15-25)27(32)29-24-12-16-26(17-13-24)38(35,36)30-18-4-2-3-5-19-30/h6-17H,2-5,18-20H2,1H3,(H,29,32)