N-(3-bromanyl-4-ethyl-phenyl)-4-[2-(6-methylpyridin-3-yl)ethyl]isoquinolin-1-amine

Systemtic Name: N-(3-bromanyl-4-ethyl-phenyl)-4-[2-(6-methylpyridin-3-yl)ethyl]isoquinolin-1-amine Openeye Name: N-(3-bromo-4-ethyl-phenyl)-4-[2-(6-methyl-3-pyridyl)ethyl]isoquinolin-1-amine CAS Name: N-(3-bromo-4-ethylphenyl)-4-[2-(6-methyl-3-pyridinyl)ethyl]-1-isoquinolinamine IUPAC Name: N-(3-bromo-4-ethylphenyl)-4-[2-(6-methylpyridin-3-yl)ethyl]isoquinolin-1-amine Traditional Name: (3-bromo-4-ethyl-phenyl)-[4-[2-(6-methyl-3-pyridyl)ethyl]-1-isoquinolyl]amine Formula: C25H24BrN3 MolecularWeight: 446.38216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=C(C=C4)C)Br

Isomeric SMILES

CCC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=C(C=C4)C)Br

InChI

InChI=1S/C25H24BrN3/c1-3-19-12-13-21(14-24(19)26)29-25-23-7-5-4-6-22(23)20(16-28-25)11-10-18-9-8-17(2)27-15-18/h4-9,12-16H,3,10-11H2,1-2H3,(H,28,29)