2-(4-bromanyl-8-chloranyl-naphthalen-1-yl)sulfanyl-N-isoquinolin-5-yl-ethanamide

Systemtic Name: 2-(4-bromanyl-8-chloranyl-naphthalen-1-yl)sulfanyl-N-isoquinolin-5-yl-ethanamide Openeye Name: 2-[(4-bromo-8-chloro-1-naphthyl)sulfanyl]-N-(5-isoquinolyl)acetamide CAS Name: 2-[(4-bromo-8-chloro-1-naphthalenyl)thio]-N-(5-isoquinolinyl)acetamide IUPAC Name: 2-(4-bromo-8-chloronaphthalen-1-yl)sulfanyl-N-isoquinolin-5-ylacetamide Traditional Name: 2-[(4-bromo-8-chloro-1-naphthyl)thio]-N-(5-isoquinolyl)acetamide Formula: C21H14BrClN2OS MolecularWeight: 457.77066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CSC3=C4C(=C(C=C3)Br)C=CC=C4Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CSC3=C4C(=C(C=C3)Br)C=CC=C4Cl

InChI

InChI=1S/C21H14BrClN2OS/c22-16-7-8-19(21-15(16)4-2-5-17(21)23)27-12-20(26)25-18-6-1-3-13-11-24-10-9-14(13)18/h1-11H,12H2,(H,25,26)