4-[(2S)-butan-2-yl]-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-[(2S)-butan-2-yl]-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzenesulfonamide Openeye Name: 4-[(1S)-1-methylpropyl]-N-[1-(p-tolylsulfonyl)-4-piperidyl]benzenesulfonamide CAS Name: 4-[(2S)-butan-2-yl]-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-[(2S)-butan-2-yl]-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzenesulfonamide Traditional Name: 4-[(1S)-1-methylpropyl]-N-(1-tosyl-4-piperidyl)benzenesulfonamide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H30N2O4S2/c1-4-18(3)19-7-11-21(12-8-19)29(25,26)23-20-13-15-24(16-14-20)30(27,28)22-9-5-17(2)6-10-22/h5-12,18,20,23H,4,13-16H2,1-3H3/t18-/m0/s1