N-[1-[2-(4-fluoranyl-3H-inden-1-yl)ethyl]piperidin-4-yl]isoquinoline-5-sulfonamide

Systemtic Name: N-[1-[2-(4-fluoranyl-3H-inden-1-yl)ethyl]piperidin-4-yl]isoquinoline-5-sulfonamide Openeye Name: N-[1-[2-(4-fluoro-3H-inden-1-yl)ethyl]-4-piperidyl]isoquinoline-5-sulfonamide CAS Name: N-[1-[2-(4-fluoro-3H-inden-1-yl)ethyl]-4-piperidinyl]-5-isoquinolinesulfonamide IUPAC Name: N-[1-[2-(4-fluoro-3H-inden-1-yl)ethyl]piperidin-4-yl]isoquinoline-5-sulfonamide Traditional Name: N-[1-[2-(4-fluoro-3H-inden-1-yl)ethyl]-4-piperidyl]isoquinoline-5-sulfonamide Formula: C25H26FN3O2S MolecularWeight: 451.556243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCC4=CCC5=C4C=CC=C5F

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCC4=CCC5=C4C=CC=C5F

InChI

InChI=1S/C25H26FN3O2S/c26-24-5-2-4-21-18(7-8-23(21)24)10-14-29-15-11-20(12-16-29)28-32(30,31)25-6-1-3-19-17-27-13-9-22(19)25/h1-7,9,13,17,20,28H,8,10-12,14-16H2