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

Systemtic Name: 4-[2-(6-methylpyridin-3-yl)ethyl]-N-[4-propyl-3-(trifluoromethyl)phenyl]isoquinolin-1-amine Openeye Name: 4-[2-(6-methyl-3-pyridyl)ethyl]-N-[4-propyl-3-(trifluoromethyl)phenyl]isoquinolin-1-amine CAS Name: 4-[2-(6-methyl-3-pyridinyl)ethyl]-N-[4-propyl-3-(trifluoromethyl)phenyl]-1-isoquinolinamine IUPAC Name: 4-[2-(6-methylpyridin-3-yl)ethyl]-N-[4-propyl-3-(trifluoromethyl)phenyl]isoquinolin-1-amine Traditional Name: [4-[2-(6-methyl-3-pyridyl)ethyl]-1-isoquinolyl]-[4-propyl-3-(trifluoromethyl)phenyl]amine Formula: C27H26F3N3 MolecularWeight: 449.51065

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=C(C=C4)C)C(F)(F)F

Isomeric SMILES

CCCC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=C(C=C4)C)C(F)(F)F

InChI

InChI=1S/C27H26F3N3/c1-3-6-20-13-14-22(15-25(20)27(28,29)30)33-26-24-8-5-4-7-23(24)21(17-32-26)12-11-19-10-9-18(2)31-16-19/h4-5,7-10,13-17H,3,6,11-12H2,1-2H3,(H,32,33)