2-(8-azanylisoquinolin-5-yl)sulfanylethanol

Systemtic Name: 2-(8-azanylisoquinolin-5-yl)sulfanylethanol Openeye Name: 2-[(8-amino-5-isoquinolyl)sulfanyl]ethanol CAS Name: 2-[(8-amino-5-isoquinolinyl)thio]ethanol IUPAC Name: 2-(8-aminoisoquinolin-5-yl)sulfanylethanol Traditional Name: 2-[(8-amino-5-isoquinolyl)thio]ethanol Formula: C11H12N2OS MolecularWeight: 220.29078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CN=CC2=C1N)SCCO

Isomeric SMILES

C1=CC(=C2C=CN=CC2=C1N)SCCO

InChI

InChI=1S/C11H12N2OS/c12-10-1-2-11(15-6-5-14)8-3-4-13-7-9(8)10/h1-4,7,14H,5-6,12H2