N-(3-bromanyl-5-methyl-phenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine

Systemtic Name: N-(3-bromanyl-5-methyl-phenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine Openeye Name: N-(3-bromo-5-methyl-phenyl)-4-(4-pyridylmethyl)isoquinolin-1-amine CAS Name: N-(3-bromo-5-methylphenyl)-4-(pyridin-4-ylmethyl)-1-isoquinolinamine IUPAC Name: N-(3-bromo-5-methylphenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine Traditional Name: (3-bromo-5-methyl-phenyl)-[4-(4-pyridylmethyl)-1-isoquinolyl]amine Formula: C22H18BrN3 MolecularWeight: 404.30242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)Br)NC2=NC=C(C3=CC=CC=C32)CC4=CC=NC=C4

Isomeric SMILES

CC1=CC(=CC(=C1)Br)NC2=NC=C(C3=CC=CC=C32)CC4=CC=NC=C4

InChI

InChI=1S/C22H18BrN3/c1-15-10-18(23)13-19(11-15)26-22-21-5-3-2-4-20(21)17(14-25-22)12-16-6-8-24-9-7-16/h2-11,13-14H,12H2,1H3,(H,25,26)