N-(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)-2-(pyridin-4-ylmethylamino)ethanamide

Systemtic Name: N-(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)-2-(pyridin-4-ylmethylamino)ethanamide Openeye Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)-2-(4-pyridylmethylamino)acetamide CAS Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)-2-(pyridin-4-ylmethylamino)acetamide IUPAC Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)-2-(pyridin-4-ylmethylamino)acetamide Traditional Name: N-(7-chloro-1-keto-2H-isoquinolin-6-yl)-2-(4-pyridylmethylamino)acetamide Formula: C17H15ClN4O2 MolecularWeight: 342.7796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=O)C2=CC(=C(C=C21)NC(=O)CNCC3=CC=NC=C3)Cl

Isomeric SMILES

C1=CNC(=O)C2=CC(=C(C=C21)NC(=O)CNCC3=CC=NC=C3)Cl

InChI

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