N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C18H30N3O4S2+ MolecularWeight: 416.5785

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C18H29N3O4S2/c1-18(2,20-9-11-25-12-10-20)14-19-17(22)15-5-7-21(8-6-15)27(23,24)16-4-3-13-26-16/h3-4,13,15H,5-12,14H2,1-2H3,(H,19,22)/p+1