3-[3-(1-benzofuran-3-yl)propyl]-1-piperidin-4-yl-isoquinoline-5-sulfonamide

Systemtic Name: 3-[3-(1-benzofuran-3-yl)propyl]-1-piperidin-4-yl-isoquinoline-5-sulfonamide Openeye Name: 3-[3-(benzofuran-3-yl)propyl]-1-(4-piperidyl)isoquinoline-5-sulfonamide CAS Name: 3-[3-(3-benzofuranyl)propyl]-1-(4-piperidinyl)-5-isoquinolinesulfonamide IUPAC Name: 3-[3-(1-benzofuran-3-yl)propyl]-1-piperidin-4-ylisoquinoline-5-sulfonamide Traditional Name: 3-[3-(benzofuran-3-yl)propyl]-1-(4-piperidyl)isoquinoline-5-sulfonamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C3C=CC=C(C3=CC(=N2)CCCC4=COC5=CC=CC=C54)S(=O)(=O)N

Isomeric SMILES

C1CNCCC1C2=C3C=CC=C(C3=CC(=N2)CCCC4=COC5=CC=CC=C54)S(=O)(=O)N

InChI

InChI=1S/C25H27N3O3S/c26-32(29,30)24-10-4-8-21-22(24)15-19(28-25(21)17-11-13-27-14-12-17)6-3-5-18-16-31-23-9-2-1-7-20(18)23/h1-2,4,7-10,15-17,27H,3,5-6,11-14H2,(H2,26,29,30)