2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)propanamide

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)propanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)propanamide CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-N-(3-sulfamoylphenyl)propanamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)propanamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazino]-N-(3-sulfamoylphenyl)propionamide Formula: C19H31N5O5S2 MolecularWeight: 473.60994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H31N5O5S2/c1-16(19(25)21-17-7-6-8-18(15-17)30(20,26)27)22-11-13-24(14-12-22)31(28,29)23-9-4-2-3-5-10-23/h6-8,15-16H,2-5,9-14H2,1H3,(H,21,25)(H2,20,26,27)