N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C21H23ClN3O4S2+ MolecularWeight: 481.00802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC2=CC=C(O2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC2=CC=C(O2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H22ClN3O4S2/c22-17-5-3-16(4-6-17)19-8-7-18(29-19)14-23-20(26)15-24-9-11-25(12-10-24)31(27,28)21-2-1-13-30-21/h1-8,13H,9-12,14-15H2,(H,23,26)/p+1