3-(phenylmethylsulfanyl)pentan-1-amine

Systemtic Name: 3-(phenylmethylsulfanyl)pentan-1-amine Openeye Name: 3-benzylsulfanylpentan-1-amine CAS Name: 3-(phenylmethylthio)-1-pentanamine IUPAC Name: 3-benzylsulfanylpentan-1-amine Traditional Name: 3-(benzylthio)pentylamine Formula: C12H19NS MolecularWeight: 209.35096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCN)SCC1=CC=CC=C1

Isomeric SMILES

CCC(CCN)SCC1=CC=CC=C1

InChI

InChI=1S/C12H19NS/c1-2-12(8-9-13)14-10-11-6-4-3-5-7-11/h3-7,12H,2,8-10,13H2,1H3