[4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[(4-besylpiperazino)methyl]phenyl]-pyrrolidino-methanone Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O3S/c26-22(24-12-4-5-13-24)20-10-8-19(9-11-20)18-23-14-16-25(17-15-23)29(27,28)21-6-2-1-3-7-21/h1-3,6-11H,4-5,12-18H2