N-[1-(4-phenylsulfanylbutanoyl)piperidin-4-yl]benzenesulfonamide

Systemtic Name: N-[1-(4-phenylsulfanylbutanoyl)piperidin-4-yl]benzenesulfonamide Openeye Name: N-[1-(4-phenylsulfanylbutanoyl)-4-piperidyl]benzenesulfonamide CAS Name: N-[1-[1-oxo-4-(phenylthio)butyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: N-[1-(4-phenylsulfanylbutanoyl)piperidin-4-yl]benzenesulfonamide Traditional Name: N-[1-[4-(phenylthio)butanoyl]-4-piperidyl]benzenesulfonamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=CC=C2)C(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=CC=C2)C(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S2/c24-21(12-7-17-27-19-8-3-1-4-9-19)23-15-13-18(14-16-23)22-28(25,26)20-10-5-2-6-11-20/h1-6,8-11,18,22H,7,12-17H2