1-isoquinolin-5-ylsulfonyl-N-phenethyl-piperidin-4-amine

Systemtic Name: 1-isoquinolin-5-ylsulfonyl-N-phenethyl-piperidin-4-amine Openeye Name: 1-(5-isoquinolylsulfonyl)-N-phenethyl-piperidin-4-amine CAS Name: 1-(5-isoquinolinylsulfonyl)-N-phenethyl-4-piperidinamine IUPAC Name: 1-isoquinolin-5-ylsulfonyl-N-phenethylpiperidin-4-amine Traditional Name: [1-(5-isoquinolylsulfonyl)-4-piperidyl]-phenethyl-amine Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCC1NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

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