4-[[5-[(7-bromanyl-1-butyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[(7-bromanyl-1-butyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[(7-bromo-1-butyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[(7-bromo-1-butyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[(7-bromo-1-butyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[(7-bromo-1-butyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazol-1-yl]methyl]benzonitrile Formula: C25H27BrN4 MolecularWeight: 463.41268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=C(CCN1CC3=CN=CN3CC4=CC=C(C=C4)C#N)C=CC(=C2)Br

Isomeric SMILES

CCCCC1C2=C(CCN1CC3=CN=CN3CC4=CC=C(C=C4)C#N)C=CC(=C2)Br

InChI

InChI=1S/C25H27BrN4/c1-2-3-4-25-24-13-22(26)10-9-21(24)11-12-29(25)17-23-15-28-18-30(23)16-20-7-5-19(14-27)6-8-20/h5-10,13,15,18,25H,2-4,11-12,16-17H2,1H3