2-(5-methoxyisoquinolin-1-yl)sulfanylethanamide

Systemtic Name: 2-(5-methoxyisoquinolin-1-yl)sulfanylethanamide Openeye Name: 2-[(5-methoxy-1-isoquinolyl)sulfanyl]acetamide CAS Name: 2-[(5-methoxy-1-isoquinolinyl)thio]acetamide IUPAC Name: 2-(5-methoxyisoquinolin-1-yl)sulfanylacetamide Traditional Name: 2-[(5-methoxy-1-isoquinolyl)thio]acetamide Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=CN=C2SCC(=O)N

Isomeric SMILES

COC1=CC=CC2=C1C=CN=C2SCC(=O)N

InChI

InChI=1S/C12H12N2O2S/c1-16-10-4-2-3-9-8(10)5-6-14-12(9)17-7-11(13)15/h2-6H,7H2,1H3,(H2,13,15)