N-[[1-[3-(4-fluoranylphenoxy)propyl]piperidin-4-yl]methyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[[1-[3-(4-fluoranylphenoxy)propyl]piperidin-4-yl]methyl]isoquinoline-5-sulfonamide Openeye Name: N-[[1-[3-(4-fluorophenoxy)propyl]-4-piperidyl]methyl]isoquinoline-5-sulfonamide CAS Name: N-[[1-[3-(4-fluorophenoxy)propyl]-4-piperidinyl]methyl]-5-isoquinolinesulfonamide IUPAC Name: N-[[1-[3-(4-fluorophenoxy)propyl]piperidin-4-yl]methyl]isoquinoline-5-sulfonamide Traditional Name: N-[[1-[3-(4-fluorophenoxy)propyl]-4-piperidyl]methyl]isoquinoline-5-sulfonamide Formula: C24H28FN3O3S MolecularWeight: 457.560823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCCOC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCCOC4=CC=C(C=C4)F

InChI

InChI=1S/C24H28FN3O3S/c25-21-5-7-22(8-6-21)31-16-2-13-28-14-10-19(11-15-28)17-27-32(29,30)24-4-1-3-20-18-26-12-9-23(20)24/h1,3-9,12,18-19,27H,2,10-11,13-17H2