2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[1-(benzenesulfonyl)-3-oxo-piperazin-2-yl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[1-(benzenesulfonyl)-3-oxo-2-piperazinyl]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[1-(benzenesulfonyl)-3-oxopiperazin-2-yl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-(1-besyl-3-keto-piperazin-2-yl)-N-(3-phenylpropyl)acetamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c25-20(22-13-7-10-17-8-3-1-4-9-17)16-19-21(26)23-14-15-24(19)29(27,28)18-11-5-2-6-12-18/h1-6,8-9,11-12,19H,7,10,13-16H2,(H,22,25)(H,23,26)