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

Systemtic Name: N-[1-[3-(1-benzofuran-2-yl)propyl]piperidin-4-yl]-N-methyl-isoquinoline-5-sulfonamide Openeye Name: N-[1-[3-(benzofuran-2-yl)propyl]-4-piperidyl]-N-methyl-isoquinoline-5-sulfonamide CAS Name: N-[1-[3-(2-benzofuranyl)propyl]-4-piperidinyl]-N-methyl-5-isoquinolinesulfonamide IUPAC Name: N-[1-[3-(1-benzofuran-2-yl)propyl]piperidin-4-yl]-N-methylisoquinoline-5-sulfonamide Traditional Name: N-[1-[3-(benzofuran-2-yl)propyl]-4-piperidyl]-N-methyl-isoquinoline-5-sulfonamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)CCCC2=CC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

CN(C1CCN(CC1)CCCC2=CC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C26H29N3O3S/c1-28(33(30,31)26-10-4-7-21-19-27-14-11-24(21)26)22-12-16-29(17-13-22)15-5-8-23-18-20-6-2-3-9-25(20)32-23/h2-4,6-7,9-11,14,18-19,22H,5,8,12-13,15-17H2,1H3