N-(phenylmethyl)-2-[4-[[2-(phenylsulfonylmethyl)phenyl]methylsulfonyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(phenylmethyl)-2-[4-[[2-(phenylsulfonylmethyl)phenyl]methylsulfonyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[[2-(benzenesulfonylmethyl)phenyl]methylsulfonyl]piperazin-1-yl]-N-benzyl-acetamide CAS Name: 2-[4-[[2-(benzenesulfonylmethyl)phenyl]methylsulfonyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: 2-[4-[[2-(benzenesulfonylmethyl)phenyl]methylsulfonyl]piperazin-1-yl]-N-benzylacetamide Traditional Name: N-benzyl-2-[4-[2-(besylmethyl)benzyl]sulfonylpiperazino]acetamide Formula: C27H31N3O5S2 MolecularWeight: 541.68214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)NCC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O5S2/c31-27(28-19-23-9-3-1-4-10-23)20-29-15-17-30(18-16-29)37(34,35)22-25-12-8-7-11-24(25)21-36(32,33)26-13-5-2-6-14-26/h1-14H,15-22H2,(H,28,31)