N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-[(2-fluorophenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-[(2-fluorophenyl)methyl-methyl-amino]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-[(2-fluorophenyl)methyl-methyl-amino]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-chlorophenyl]-2-[(2-fluorophenyl)methyl-methylamino]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-2-[(2-fluorophenyl)methyl-methylamino]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-[(2-fluorobenzyl)-methyl-amino]acetamide Formula: C22H27ClFN3O3S MolecularWeight: 467.984483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1F)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C22H27ClFN3O3S/c1-26(15-17-8-4-5-9-20(17)24)16-22(28)25-21-14-18(10-11-19(21)23)31(29,30)27-12-6-2-3-7-13-27/h4-5,8-11,14H,2-3,6-7,12-13,15-16H2,1H3,(H,25,28)