2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)ethanamide Openeye Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)acetamide CAS Name: 2-[4-(3-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-cyanophenyl)acetamide IUPAC Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)acetamide Traditional Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)acetamide Formula: C19H20ClN4O3S+ MolecularWeight: 419.9051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C#N)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C#N)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H19ClN4O3S/c20-16-5-3-6-17(12-16)28(26,27)24-10-8-23(9-11-24)14-19(25)22-18-7-2-1-4-15(18)13-21/h1-7,12H,8-11,14H2,(H,22,25)/p+1