4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzamide

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzamide Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]benzamide CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]benzamide IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzamide Traditional Name: 4-[1-(4-ethylpiperazino)-3-isoquinolyl]benzamide Formula: C22H24N4O MolecularWeight: 360.45216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H24N4O/c1-2-25-11-13-26(14-12-25)22-19-6-4-3-5-18(19)15-20(24-22)16-7-9-17(10-8-16)21(23)27/h3-10,15H,2,11-14H2,1H3,(H2,23,27)