N-[2-[1-[2-(4-fluoranylphenoxy)ethyl]piperidin-4-yl]ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-[1-[2-(4-fluoranylphenoxy)ethyl]piperidin-4-yl]ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-[1-[2-(4-fluorophenoxy)ethyl]-4-piperidyl]ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-[1-[2-(4-fluorophenoxy)ethyl]-4-piperidinyl]ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-[1-[2-(4-fluorophenoxy)ethyl]piperidin-4-yl]ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-[1-[2-(4-fluorophenoxy)ethyl]-4-piperidyl]ethyl]isoquinoline-5-sulfonamide Formula: C24H28FN3O3S MolecularWeight: 457.560823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCOC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1CCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCOC4=CC=C(C=C4)F

InChI

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