1-[4-[phenylsulfonyl(1,2,3,4-tetrahydroquinolin-2-yl)methyl]piperazin-1-yl]isoquinoline

Systemtic Name: 1-[4-[phenylsulfonyl(1,2,3,4-tetrahydroquinolin-2-yl)methyl]piperazin-1-yl]isoquinoline Openeye Name: 1-[4-[benzenesulfonyl(1,2,3,4-tetrahydroquinolin-2-yl)methyl]piperazin-1-yl]isoquinoline CAS Name: 1-[4-[benzenesulfonyl(1,2,3,4-tetrahydroquinolin-2-yl)methyl]-1-piperazinyl]isoquinoline IUPAC Name: 1-[4-[benzenesulfonyl(1,2,3,4-tetrahydroquinolin-2-yl)methyl]piperazin-1-yl]isoquinoline Traditional Name: 1-[4-[besyl(1,2,3,4-tetrahydroquinolin-2-yl)methyl]piperazino]isoquinoline Formula: C29H30N4O2S MolecularWeight: 498.6391

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC1C(N3CCN(CC3)C4=NC=CC5=CC=CC=C54)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1CC2=CC=CC=C2NC1C(N3CCN(CC3)C4=NC=CC5=CC=CC=C54)S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C29H30N4O2S/c34-36(35,24-10-2-1-3-11-24)29(27-15-14-23-9-5-7-13-26(23)31-27)33-20-18-32(19-21-33)28-25-12-6-4-8-22(25)16-17-30-28/h1-13,16-17,27,29,31H,14-15,18-21H2