N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC2=C1C=CC(=C2)S(=O)(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CNCC2=C1C=CC(=C2)S(=O)(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

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