N-[2-(azepan-1-yl)ethyl]-2-[3,4-bis(methylsulfamoyl)pyrrol-1-yl]ethanamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-[3,4-bis(methylsulfamoyl)pyrrol-1-yl]ethanamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-[3,4-bis(methylsulfamoyl)pyrrol-1-yl]acetamide CAS Name: N-[2-(1-azepanyl)ethyl]-2-[3,4-bis(methylsulfamoyl)-1-pyrrolyl]acetamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-[3,4-bis(methylsulfamoyl)pyrrol-1-yl]acetamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-2-[3,4-bis(methylsulfamoyl)pyrrol-1-yl]acetamide Formula: C16H29N5O5S2 MolecularWeight: 435.56196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CN(C=C1S(=O)(=O)NC)CC(=O)NCCN2CCCCCC2

Isomeric SMILES

CNS(=O)(=O)C1=CN(C=C1S(=O)(=O)NC)CC(=O)NCCN2CCCCCC2

InChI

InChI=1S/C16H29N5O5S2/c1-17-27(23,24)14-11-21(12-15(14)28(25,26)18-2)13-16(22)19-7-10-20-8-5-3-4-6-9-20/h11-12,17-18H,3-10,13H2,1-2H3,(H,19,22)