N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-piperidin-1-ylcarbonyl-phenyl]quinoline-8-sulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-piperidin-1-ylcarbonyl-phenyl]quinoline-8-sulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-piperidinyl)methyl]phenyl]-8-quinolinesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(piperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide Formula: C30H30N4O3S MolecularWeight: 526.6492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)N5CCC6=CC=CC=C6C5

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C30H30N4O3S/c35-30(33-17-4-1-5-18-33)26-20-25(13-14-27(26)34-19-15-22-8-2-3-9-24(22)21-34)32-38(36,37)28-12-6-10-23-11-7-16-31-29(23)28/h2-3,6-14,16,20,32H,1,4-5,15,17-19,21H2