4-(azepan-1-ylsulfonyl)-N-phenethyl-benzenesulfonamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-phenethyl-benzenesulfonamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-phenethyl-benzenesulfonamide CAS Name: 4-(1-azepanylsulfonyl)-N-phenethylbenzenesulfonamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-phenethylbenzenesulfonamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-phenethyl-benzenesulfonamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O4S2/c23-27(24,21-15-14-18-8-4-3-5-9-18)19-10-12-20(13-11-19)28(25,26)22-16-6-1-2-7-17-22/h3-5,8-13,21H,1-2,6-7,14-17H2