1-isoquinolin-5-yl-3-[[4-(4-methylpiperidin-1-yl)phenyl]methyl]urea hydrochloride

Systemtic Name: 1-isoquinolin-5-yl-3-[[4-(4-methylpiperidin-1-yl)phenyl]methyl]urea hydrochloride Openeye Name: 1-(5-isoquinolyl)-3-[[4-(4-methyl-1-piperidyl)phenyl]methyl]urea hydrochloride CAS Name: 1-(5-isoquinolinyl)-3-[[4-(4-methyl-1-piperidinyl)phenyl]methyl]urea hydrochloride IUPAC Name: 1-isoquinolin-5-yl-3-[[4-(4-methylpiperidin-1-yl)phenyl]methyl]urea hydrochloride Traditional Name: 1-(5-isoquinolyl)-3-[4-(4-methylpiperidino)benzyl]urea hydrochloride Formula: C23H27ClN4O MolecularWeight: 410.93968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)CNC(=O)NC3=CC=CC4=C3C=CN=C4.Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)CNC(=O)NC3=CC=CC4=C3C=CN=C4.Cl

InChI

InChI=1S/C23H26N4O.ClH/c1-17-10-13-27(14-11-17)20-7-5-18(6-8-20)15-25-23(28)26-22-4-2-3-19-16-24-12-9-21(19)22;/h2-9,12,16-17H,10-11,13-15H2,1H3,(H2,25,26,28);1H