1-isoquinolin-1-ylsulfonyl-N-phenethyl-piperidin-3-amine

Systemtic Name: 1-isoquinolin-1-ylsulfonyl-N-phenethyl-piperidin-3-amine Openeye Name: 1-(1-isoquinolylsulfonyl)-N-phenethyl-piperidin-3-amine CAS Name: 1-(1-isoquinolinylsulfonyl)-N-phenethyl-3-piperidinamine IUPAC Name: 1-isoquinolin-1-ylsulfonyl-N-phenethylpiperidin-3-amine Traditional Name: [1-(1-isoquinolylsulfonyl)-3-piperidyl]-phenethyl-amine Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=NC=CC3=CC=CC=C32)NCCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=NC=CC3=CC=CC=C32)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O2S/c26-28(27,22-21-11-5-4-9-19(21)13-15-24-22)25-16-6-10-20(17-25)23-14-12-18-7-2-1-3-8-18/h1-5,7-9,11,13,15,20,23H,6,10,12,14,16-17H2