2-(4-phenylpiperazin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(4-phenyl-1-piperazin-1-iumyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C22H29N4O3S+ MolecularWeight: 429.55566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H28N4O3S/c27-22(18-24-14-16-25(17-15-24)20-6-2-1-3-7-20)23-19-8-10-21(11-9-19)30(28,29)26-12-4-5-13-26/h1-3,6-11H,4-5,12-18H2,(H,23,27)/p+1