2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone Traditional Name: 2-(4-benzylsulfonylpiperazino)-1-pyrrolidino-ethanone Formula: C17H25N3O3S MolecularWeight: 351.4637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H25N3O3S/c21-17(19-8-4-5-9-19)14-18-10-12-20(13-11-18)24(22,23)15-16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15H2