N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]tetralin-6-sulfonamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]tetralin-6-sulfonamide Formula: C28H34N4O2S MolecularWeight: 490.66016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NCC(C3=CN=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NCC(C3=CN=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H34N4O2S/c33-35(34,27-13-12-24-9-4-5-10-25(24)19-27)30-21-28(26-11-6-14-29-20-26)32-17-15-31(16-18-32)22-23-7-2-1-3-8-23/h1-3,6-8,11-14,19-20,28,30H,4-5,9-10,15-18,21-22H2