4-[5-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]pyridin-2-yl]butan-2-ol

Systemtic Name: 4-[5-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]pyridin-2-yl]butan-2-ol Openeye Name: 4-[5-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-2-pyridyl]butan-2-ol CAS Name: 4-[5-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-2-pyridinyl]-2-butanol IUPAC Name: 4-[5-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]pyridin-2-yl]butan-2-ol Traditional Name: 4-[5-[1-(4-ethylpiperazino)-3-isoquinolyl]-2-pyridyl]butan-2-ol Formula: C24H30N4O MolecularWeight: 390.5212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O/c1-3-27-12-14-28(15-13-27)24-22-7-5-4-6-19(22)16-23(26-24)20-9-11-21(25-17-20)10-8-18(2)29/h4-7,9,11,16-18,29H,3,8,10,12-15H2,1-2H3