N-methyl-N-(phenylmethyl)-4-[(3S)-3-phenylpiperidin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N-methyl-N-(phenylmethyl)-4-[(3S)-3-phenylpiperidin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N-benzyl-N-methyl-4-[[(3S)-3-phenyl-1-piperidyl]sulfonyl]benzenesulfonamide CAS Name: N-methyl-N-(phenylmethyl)-4-[[(3S)-3-phenyl-1-piperidinyl]sulfonyl]benzenesulfonamide IUPAC Name: N-benzyl-N-methyl-4-[(3S)-3-phenylpiperidin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-benzyl-N-methyl-4-[(3S)-3-phenylpiperidino]sulfonyl-benzenesulfonamide Formula: C25H28N2O4S2 MolecularWeight: 484.63082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC[C@H](C3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O4S2/c1-26(19-21-9-4-2-5-10-21)32(28,29)24-14-16-25(17-15-24)33(30,31)27-18-8-13-23(20-27)22-11-6-3-7-12-22/h2-7,9-12,14-17,23H,8,13,18-20H2,1H3/t23-/m1/s1