2-[(4-methoxyphenyl)methylsulfanyl]-N'-methyl-propane-1,3-diamine

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-N'-methyl-propane-1,3-diamine Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-N'-methyl-propane-1,3-diamine CAS Name: 2-[(4-methoxyphenyl)methylthio]-N'-methylpropane-1,3-diamine IUPAC Name: 2-[(4-methoxyphenyl)methylsulfanyl]-N'-methylpropane-1,3-diamine Traditional Name: [3-amino-2-(p-anisylthio)propyl]-methyl-amine Formula: C12H20N2OS MolecularWeight: 240.365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCC(CN)SCC1=CC=C(C=C1)OC

Isomeric SMILES

CNCC(CN)SCC1=CC=C(C=C1)OC

InChI

InChI=1S/C12H20N2OS/c1-14-8-12(7-13)16-9-10-3-5-11(15-2)6-4-10/h3-6,12,14H,7-9,13H2,1-2H3