2-(3-butylisoquinolin-1-yl)sulfanyl-N,N-dimethyl-ethanamine

Systemtic Name: 2-(3-butylisoquinolin-1-yl)sulfanyl-N,N-dimethyl-ethanamine Openeye Name: 2-[(3-butyl-1-isoquinolyl)sulfanyl]-N,N-dimethyl-ethanamine CAS Name: 2-[(3-butyl-1-isoquinolinyl)thio]-N,N-dimethylethanamine IUPAC Name: 2-(3-butylisoquinolin-1-yl)sulfanyl-N,N-dimethylethanamine Traditional Name: 2-[(3-butyl-1-isoquinolyl)thio]ethyl-dimethyl-amine Formula: C17H24N2S MolecularWeight: 288.45086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)SCCN(C)C

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)SCCN(C)C

InChI

InChI=1S/C17H24N2S/c1-4-5-9-15-13-14-8-6-7-10-16(14)17(18-15)20-12-11-19(2)3/h6-8,10,13H,4-5,9,11-12H2,1-3H3