N-(1,3-benzodioxol-5-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(4-besylpiperazino)acetamide Formula: C19H21N3O5S MolecularWeight: 403.45214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H21N3O5S/c23-19(20-15-6-7-17-18(12-15)27-14-26-17)13-21-8-10-22(11-9-21)28(24,25)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2,(H,20,23)