tert-butyl 4-[2-(thiophen-2-ylsulfonylamino)ethyl]piperazin-4-ium-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(thiophen-2-ylsulfonylamino)ethyl]piperazin-4-ium-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-thienylsulfonylamino)ethyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[2-(thiophen-2-ylsulfonylamino)ethyl]-1-piperazin-4-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(thiophen-2-ylsulfonylamino)ethyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[2-(2-thienylsulfonylamino)ethyl]piperazin-4-ium-1-carboxylic acid tert-butyl ester Formula: C15H26N3O4S2+ MolecularWeight: 376.51464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC[NH+](CC1)CCNS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[NH+](CC1)CCNS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C15H25N3O4S2/c1-15(2,3)22-14(19)18-10-8-17(9-11-18)7-6-16-24(20,21)13-5-4-12-23-13/h4-5,12,16H,6-11H2,1-3H3/p+1