N-(3-methyl-4-propan-2-yl-phenyl)-4-(2-pyridin-3-ylethyl)isoquinolin-1-amine

Systemtic Name: N-(3-methyl-4-propan-2-yl-phenyl)-4-(2-pyridin-3-ylethyl)isoquinolin-1-amine Openeye Name: N-(4-isopropyl-3-methyl-phenyl)-4-[2-(3-pyridyl)ethyl]isoquinolin-1-amine CAS Name: N-(3-methyl-4-propan-2-ylphenyl)-4-[2-(3-pyridinyl)ethyl]-1-isoquinolinamine IUPAC Name: N-(3-methyl-4-propan-2-ylphenyl)-4-(2-pyridin-3-ylethyl)isoquinolin-1-amine Traditional Name: (4-isopropyl-3-methyl-phenyl)-[4-[2-(3-pyridyl)ethyl]-1-isoquinolyl]amine Formula: C26H27N3 MolecularWeight: 381.51268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=CC=C4)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=CC=C4)C(C)C

InChI

InChI=1S/C26H27N3/c1-18(2)23-13-12-22(15-19(23)3)29-26-25-9-5-4-8-24(25)21(17-28-26)11-10-20-7-6-14-27-16-20/h4-9,12-18H,10-11H2,1-3H3,(H,28,29)