N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C20H25N4O4S+ MolecularWeight: 417.5019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCNC(=O)C3

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCNC(=O)C3

InChI

InChI=1S/C20H24N4O4S/c1-23(13-16-5-3-2-4-6-16)29(27,28)18-9-7-17(8-10-18)22-20(26)15-24-12-11-21-19(25)14-24/h2-10H,11-15H2,1H3,(H,21,25)(H,22,26)/p+1