2-[(3-cyanophenyl)amino]-N-isoquinolin-6-yl-ethanamide

Systemtic Name: 2-[(3-cyanophenyl)amino]-N-isoquinolin-6-yl-ethanamide Openeye Name: 2-(3-cyanoanilino)-N-(6-isoquinolyl)acetamide CAS Name: 2-(3-cyanoanilino)-N-(6-isoquinolinyl)acetamide IUPAC Name: 2-(3-cyanoanilino)-N-isoquinolin-6-ylacetamide Traditional Name: 2-(3-cyanoanilino)-N-(6-isoquinolyl)acetamide Formula: C18H14N4O MolecularWeight: 302.32996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC(=O)NC2=CC3=C(C=C2)C=NC=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NCC(=O)NC2=CC3=C(C=C2)C=NC=C3)C#N

InChI

InChI=1S/C18H14N4O/c19-10-13-2-1-3-16(8-13)21-12-18(23)22-17-5-4-15-11-20-7-6-14(15)9-17/h1-9,11,21H,12H2,(H,22,23)