N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[1-(4-chlorophenyl)ethylamino]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[1-(4-chlorophenyl)ethylamino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[1-(4-chlorophenyl)ethylamino]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[1-(4-chlorophenyl)ethylamino]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[1-(4-chlorophenyl)ethylamino]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[1-(4-chlorophenyl)ethylamino]acetamide Formula: C23H30ClN3O3S MolecularWeight: 464.0206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CNC(C)C2=CC=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CNC(C)C2=CC=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30ClN3O3S/c1-17-7-12-21(15-22(17)31(29,30)27-13-5-3-4-6-14-27)26-23(28)16-25-18(2)19-8-10-20(24)11-9-19/h7-12,15,18,25H,3-6,13-14,16H2,1-2H3,(H,26,28)