N-[1-[2-(1-benzofuran-3-yl)ethyl]piperidin-4-yl]-1-chloranyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[1-[2-(1-benzofuran-3-yl)ethyl]piperidin-4-yl]-1-chloranyl-isoquinoline-5-sulfonamide Openeye Name: N-[1-[2-(benzofuran-3-yl)ethyl]-4-piperidyl]-1-chloro-isoquinoline-5-sulfonamide CAS Name: N-[1-[2-(3-benzofuranyl)ethyl]-4-piperidinyl]-1-chloro-5-isoquinolinesulfonamide IUPAC Name: N-[1-[2-(1-benzofuran-3-yl)ethyl]piperidin-4-yl]-1-chloroisoquinoline-5-sulfonamide Traditional Name: N-[1-[2-(benzofuran-3-yl)ethyl]-4-piperidyl]-1-chloro-isoquinoline-5-sulfonamide Formula: C24H24ClN3O3S MolecularWeight: 469.98366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=CC3=C2C=CN=C3Cl)CCC4=COC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=CC3=C2C=CN=C3Cl)CCC4=COC5=CC=CC=C54

InChI

InChI=1S/C24H24ClN3O3S/c25-24-21-5-3-7-23(20(21)8-12-26-24)32(29,30)27-18-10-14-28(15-11-18)13-9-17-16-31-22-6-2-1-4-19(17)22/h1-8,12,16,18,27H,9-11,13-15H2