2-[3-(4-methylpiperazin-1-yl)isoquinolin-1-yl]ethanamide

Systemtic Name: 2-[3-(4-methylpiperazin-1-yl)isoquinolin-1-yl]ethanamide Openeye Name: 2-[3-(4-methylpiperazin-1-yl)-1-isoquinolyl]acetamide CAS Name: 2-[3-(4-methyl-1-piperazinyl)-1-isoquinolinyl]acetamide IUPAC Name: 2-[3-(4-methylpiperazin-1-yl)isoquinolin-1-yl]acetamide Traditional Name: 2-[3-(4-methylpiperazino)-1-isoquinolyl]acetamide Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=CC=CC=C3C(=N2)CC(=O)N

Isomeric SMILES

CN1CCN(CC1)C2=CC3=CC=CC=C3C(=N2)CC(=O)N

InChI

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