5-fluoranyl-1-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 5-fluoranyl-1-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-5-fluoro-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-5-fluoro-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-5-fluoro-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[(4-besylpiperazino)methyl]-5-fluoro-1,2,3,4-tetrahydroisoquinoline Formula: C20H24FN3O2S MolecularWeight: 389.486863

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=C1C(=CC=C2)F)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNC(C2=C1C(=CC=C2)F)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H24FN3O2S/c21-19-8-4-7-18-17(19)9-10-22-20(18)15-23-11-13-24(14-12-23)27(25,26)16-5-2-1-3-6-16/h1-8,20,22H,9-15H2