N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonyl-methylamino]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonyl-methyl-amino]acetamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H31N3O5S2/c1-18-11-12-19(2)22(15-18)33(30,31)25(3)17-23(27)24-20-9-8-10-21(16-20)32(28,29)26-13-6-4-5-7-14-26/h8-12,15-16H,4-7,13-14,17H2,1-3H3,(H,24,27)