4-[(isoquinolin-1-ylamino)methyl]-4-phenyl-N-(phenylmethyl)piperidine-1-sulfonamide

Systemtic Name: 4-[(isoquinolin-1-ylamino)methyl]-4-phenyl-N-(phenylmethyl)piperidine-1-sulfonamide Openeye Name: N-benzyl-4-[(1-isoquinolylamino)methyl]-4-phenyl-piperidine-1-sulfonamide CAS Name: 4-[(1-isoquinolinylamino)methyl]-4-phenyl-N-(phenylmethyl)-1-piperidinesulfonamide IUPAC Name: N-benzyl-4-[(isoquinolin-1-ylamino)methyl]-4-phenylpiperidine-1-sulfonamide Traditional Name: N-benzyl-4-[(1-isoquinolylamino)methyl]-4-phenyl-piperidine-1-sulfonamide Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CNC2=NC=CC3=CC=CC=C32)C4=CC=CC=C4)S(=O)(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(CNC2=NC=CC3=CC=CC=C32)C4=CC=CC=C4)S(=O)(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2S/c33-35(34,31-21-23-9-3-1-4-10-23)32-19-16-28(17-20-32,25-12-5-2-6-13-25)22-30-27-26-14-8-7-11-24(26)15-18-29-27/h1-15,18,31H,16-17,19-22H2,(H,29,30)