N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]naphthalene-1-sulfonamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]naphthalene-1-sulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]naphthalene-1-sulfonamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-1-naphthalenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]naphthalene-1-sulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]naphthalene-1-sulfonamide Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(CNS(=O)(=O)C3=CC=CC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(CNS(=O)(=O)C3=CC=CC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C28H30N4O2S/c33-35(34,28-14-6-11-24-10-4-5-13-26(24)28)30-21-27(25-12-7-15-29-20-25)32-18-16-31(17-19-32)22-23-8-2-1-3-9-23/h1-15,20,27,30H,16-19,21-22H2