1-methylsulfonyl-N-(phenylmethyl)-4-[2-(phenylsulfonyl)ethyl]piperazine-2-carboxamide

Systemtic Name: 1-methylsulfonyl-N-(phenylmethyl)-4-[2-(phenylsulfonyl)ethyl]piperazine-2-carboxamide Openeye Name: 4-[2-(benzenesulfonyl)ethyl]-N-benzyl-1-methylsulfonyl-piperazine-2-carboxamide CAS Name: 4-[2-(benzenesulfonyl)ethyl]-1-methylsulfonyl-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: 4-[2-(benzenesulfonyl)ethyl]-N-benzyl-1-methylsulfonylpiperazine-2-carboxamide Traditional Name: N-benzyl-4-(2-besylethyl)-1-mesyl-piperazine-2-carboxamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1C(=O)NCC2=CC=CC=C2)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1C(=O)NCC2=CC=CC=C2)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O5S2/c1-30(26,27)24-13-12-23(14-15-31(28,29)19-10-6-3-7-11-19)17-20(24)21(25)22-16-18-8-4-2-5-9-18/h2-11,20H,12-17H2,1H3,(H,22,25)