N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-chloranyl-N-methyl-benzenesulfonamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-chloranyl-N-methyl-benzenesulfonamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-chloro-N-methyl-benzenesulfonamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-4-chloro-N-methylbenzenesulfonamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-chloro-N-methylbenzenesulfonamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-chloro-N-methyl-benzenesulfonamide Formula: C20H25ClN2O5S2 MolecularWeight: 473.0059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN2O5S2/c1-22(29(24,25)17-9-7-16(21)8-10-17)19-15-18(11-12-20(19)28-2)30(26,27)23-13-5-3-4-6-14-23/h7-12,15H,3-6,13-14H2,1-2H3