1-(1-isoquinolin-5-ylsulfonylpiperidin-4-yl)ethanamine

Systemtic Name: 1-(1-isoquinolin-5-ylsulfonylpiperidin-4-yl)ethanamine Openeye Name: 1-[1-(5-isoquinolylsulfonyl)-4-piperidyl]ethanamine CAS Name: 1-[1-(5-isoquinolinylsulfonyl)-4-piperidinyl]ethanamine IUPAC Name: 1-(1-isoquinolin-5-ylsulfonylpiperidin-4-yl)ethanamine Traditional Name: 1-[1-(5-isoquinolylsulfonyl)-4-piperidyl]ethylamine Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3)N

Isomeric SMILES

CC(C1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3)N

InChI

InChI=1S/C16H21N3O2S/c1-12(17)13-6-9-19(10-7-13)22(20,21)16-4-2-3-14-11-18-8-5-15(14)16/h2-5,8,11-13H,6-7,9-10,17H2,1H3