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

Systemtic Name: N-(3-bromanyl-4-ethyl-phenyl)-4-[2-(2-chloranylpyridin-4-yl)ethyl]isoquinolin-1-amine Openeye Name: N-(3-bromo-4-ethyl-phenyl)-4-[2-(2-chloro-4-pyridyl)ethyl]isoquinolin-1-amine CAS Name: N-(3-bromo-4-ethylphenyl)-4-[2-(2-chloro-4-pyridinyl)ethyl]-1-isoquinolinamine IUPAC Name: N-(3-bromo-4-ethylphenyl)-4-[2-(2-chloropyridin-4-yl)ethyl]isoquinolin-1-amine Traditional Name: (3-bromo-4-ethyl-phenyl)-[4-[2-(2-chloro-4-pyridyl)ethyl]-1-isoquinolyl]amine Formula: C24H21BrClN3 MolecularWeight: 466.80064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21BrClN3/c1-2-17-9-10-19(14-22(17)25)29-24-21-6-4-3-5-20(21)18(15-28-24)8-7-16-11-12-27-23(26)13-16/h3-6,9-15H,2,7-8H2,1H3,(H,28,29)