N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-piperidin-1-ylcarbonyl-phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-piperidin-1-ylcarbonyl-phenyl]naphthalene-2-sulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]naphthalene-2-sulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-piperidinyl)methyl]phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]naphthalene-2-sulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]naphthalene-2-sulfonamide Formula: C31H31N3O3S MolecularWeight: 525.66114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)N5CCC6=CC=CC=C6C5

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C31H31N3O3S/c35-31(33-17-6-1-7-18-33)29-21-27(13-15-30(29)34-19-16-24-9-3-5-11-26(24)22-34)32-38(36,37)28-14-12-23-8-2-4-10-25(23)20-28/h2-5,8-15,20-21,32H,1,6-7,16-19,22H2