N,N-diethyl-2-(phenylmethylsulfanyl)ethanamine

Systemtic Name: N,N-diethyl-2-(phenylmethylsulfanyl)ethanamine Openeye Name: 2-benzylsulfanyl-N,N-diethyl-ethanamine CAS Name: N,N-diethyl-2-(phenylmethylthio)ethanamine IUPAC Name: 2-benzylsulfanyl-N,N-diethylethanamine Traditional Name: 2-(benzylthio)ethyl-diethyl-amine Formula: C13H21NS MolecularWeight: 223.37754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSCC1=CC=CC=C1

Isomeric SMILES

CCN(CC)CCSCC1=CC=CC=C1

InChI

InChI=1S/C13H21NS/c1-3-14(4-2)10-11-15-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3