2-(4-tert-butylphenyl)-N-isoquinolin-6-yl-2-phenylazanyl-ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-isoquinolin-6-yl-2-phenylazanyl-ethanamide Openeye Name: 2-anilino-2-(4-tert-butylphenyl)-N-(6-isoquinolyl)acetamide CAS Name: 2-anilino-2-(4-tert-butylphenyl)-N-(6-isoquinolinyl)acetamide IUPAC Name: 2-anilino-2-(4-tert-butylphenyl)-N-isoquinolin-6-ylacetamide Traditional Name: 2-anilino-2-(4-tert-butylphenyl)-N-(6-isoquinolyl)acetamide Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C(=O)NC2=CC3=C(C=C2)C=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C(=O)NC2=CC3=C(C=C2)C=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O/c1-27(2,3)22-12-9-19(10-13-22)25(29-23-7-5-4-6-8-23)26(31)30-24-14-11-21-18-28-16-15-20(21)17-24/h4-18,25,29H,1-3H3,(H,30,31)