N-isoquinolin-5-yl-2-piperazin-1-yl-propanamide

Systemtic Name: N-isoquinolin-5-yl-2-piperazin-1-yl-propanamide Openeye Name: N-(5-isoquinolyl)-2-piperazin-1-yl-propanamide CAS Name: N-(5-isoquinolinyl)-2-(1-piperazinyl)propanamide IUPAC Name: N-isoquinolin-5-yl-2-piperazin-1-ylpropanamide Traditional Name: N-(5-isoquinolyl)-2-piperazino-propionamide Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CN=C2)N3CCNCC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CN=C2)N3CCNCC3

InChI

InChI=1S/C16H20N4O/c1-12(20-9-7-17-8-10-20)16(21)19-15-4-2-3-13-11-18-6-5-14(13)15/h2-6,11-12,17H,7-10H2,1H3,(H,19,21)