N-(4-tert-butylphenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine

Systemtic Name: N-(4-tert-butylphenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine Openeye Name: N-(4-tert-butylphenyl)-4-(4-pyridylmethyl)isoquinolin-1-amine CAS Name: N-(4-tert-butylphenyl)-4-(pyridin-4-ylmethyl)-1-isoquinolinamine IUPAC Name: N-(4-tert-butylphenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine Traditional Name: (4-tert-butylphenyl)-[4-(4-pyridylmethyl)-1-isoquinolyl]amine Formula: C25H25N3 MolecularWeight: 367.4861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3/c1-25(2,3)20-8-10-21(11-9-20)28-24-23-7-5-4-6-22(23)19(17-27-24)16-18-12-14-26-15-13-18/h4-15,17H,16H2,1-3H3,(H,27,28)