N,N-diethyl-2-(3-phenylquinolin-2-yl)sulfanyl-ethanamine chloride

Systemtic Name: N,N-diethyl-2-(3-phenylquinolin-2-yl)sulfanyl-ethanamine chloride Openeye Name: N,N-diethyl-2-[(3-phenyl-2-quinolyl)sulfanyl]ethanamine chloride CAS Name: N,N-diethyl-2-[(3-phenyl-2-quinolinyl)thio]ethanamine chloride IUPAC Name: N,N-diethyl-2-(3-phenylquinolin-2-yl)sulfanylethanamine chloride Traditional Name: diethyl-[2-[(3-phenyl-2-quinolyl)thio]ethyl]amine chloride Formula: C21H24ClN2S- MolecularWeight: 371.94666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC2=CC=CC=C2C=C1C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCN(CC)CCSC1=NC2=CC=CC=C2C=C1C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H24N2S.ClH/c1-3-23(4-2)14-15-24-21-19(17-10-6-5-7-11-17)16-18-12-8-9-13-20(18)22-21;/h5-13,16H,3-4,14-15H2,1-2H3;1H/p-1