N-(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)-2-(pyridin-3-ylmethylamino)ethanamide

Systemtic Name: N-(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)-2-(pyridin-3-ylmethylamino)ethanamide Openeye Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)-2-(3-pyridylmethylamino)acetamide CAS Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)-2-(3-pyridinylmethylamino)acetamide IUPAC Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)-2-(pyridin-3-ylmethylamino)acetamide Traditional Name: N-(7-chloro-1-keto-2H-isoquinolin-6-yl)-2-(3-pyridylmethylamino)acetamide Formula: C17H15ClN4O2 MolecularWeight: 342.7796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNCC(=O)NC2=C(C=C3C(=C2)C=CNC3=O)Cl

Isomeric SMILES

C1=CC(=CN=C1)CNCC(=O)NC2=C(C=C3C(=C2)C=CNC3=O)Cl

InChI

InChI=1S/C17H15ClN4O2/c18-14-7-13-12(3-5-21-17(13)24)6-15(14)22-16(23)10-20-9-11-2-1-4-19-8-11/h1-8,20H,9-10H2,(H,21,24)(H,22,23)