N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonamide Formula: C23H32N4O2S MolecularWeight: 428.59078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=C1C=CC(=C2)S(=O)(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CNCCC2=C1C=CC(=C2)S(=O)(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H32N4O2S/c28-30(29,23-7-6-21-8-10-24-11-9-22(21)18-23)25-12-13-26-14-16-27(17-15-26)19-20-4-2-1-3-5-20/h1-7,18,24-25H,8-17,19H2