2-[5-(phenylmethylsulfanyl)-1H-indol-3-yl]propan-1-amine

Systemtic Name: 2-[5-(phenylmethylsulfanyl)-1H-indol-3-yl]propan-1-amine Openeye Name: 2-(5-benzylsulfanyl-1H-indol-3-yl)propan-1-amine CAS Name: 2-[5-(phenylmethylthio)-1H-indol-3-yl]-1-propanamine IUPAC Name: 2-(5-benzylsulfanyl-1H-indol-3-yl)propan-1-amine Traditional Name: 2-[5-(benzylthio)-1H-indol-3-yl]propylamine Formula: C18H20N2S MolecularWeight: 296.4298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN)C1=CNC2=C1C=C(C=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC(CN)C1=CNC2=C1C=C(C=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2S/c1-13(10-19)17-11-20-18-8-7-15(9-16(17)18)21-12-14-5-3-2-4-6-14/h2-9,11,13,20H,10,12,19H2,1H3