N-[3-(azepan-1-ylsulfonyl)phenyl]-2-chloranyl-5-[(3,4-dimethylphenyl)sulfamoyl]benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-chloranyl-5-[(3,4-dimethylphenyl)sulfamoyl]benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]benzamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]benzamide Formula: C27H30ClN3O5S2 MolecularWeight: 576.1272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4)C

InChI

InChI=1S/C27H30ClN3O5S2/c1-19-10-11-22(16-20(19)2)30-37(33,34)23-12-13-26(28)25(18-23)27(32)29-21-8-7-9-24(17-21)38(35,36)31-14-5-3-4-6-15-31/h7-13,16-18,30H,3-6,14-15H2,1-2H3,(H,29,32)