N-[4-chloranyl-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-7-morpholin-4-yl-isoquinolin-1-amine

Systemtic Name: N-[4-chloranyl-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-7-morpholin-4-yl-isoquinolin-1-amine Openeye Name: N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-7-morpholino-isoquinolin-1-amine CAS Name: N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-7-(4-morpholinyl)-1-isoquinolinamine IUPAC Name: N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-7-morpholin-4-ylisoquinolin-1-amine Traditional Name: [4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-(7-morpholino-1-isoquinolyl)amine Formula: C28H24ClN5O MolecularWeight: 481.97606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)C=CN=C3NC4=CC(=C(C=C4)Cl)C5=NC=C(N5)C6=CC=CC=C6

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)C=CN=C3NC4=CC(=C(C=C4)Cl)C5=NC=C(N5)C6=CC=CC=C6

InChI

InChI=1S/C28H24ClN5O/c29-25-9-7-21(16-24(25)28-31-18-26(33-28)20-4-2-1-3-5-20)32-27-23-17-22(34-12-14-35-15-13-34)8-6-19(23)10-11-30-27/h1-11,16-18H,12-15H2,(H,30,32)(H,31,33)