2-chloranyl-4,5-dimethoxy-N-(3-methylsulfanylpropyl)aniline

Systemtic Name: 2-chloranyl-4,5-dimethoxy-N-(3-methylsulfanylpropyl)aniline Openeye Name: 2-chloro-4,5-dimethoxy-N-(3-methylsulfanylpropyl)aniline CAS Name: 2-chloro-4,5-dimethoxy-N-[3-(methylthio)propyl]aniline IUPAC Name: 2-chloro-4,5-dimethoxy-N-(3-methylsulfanylpropyl)aniline Traditional Name: (2-chloro-4,5-dimethoxy-phenyl)-[3-(methylthio)propyl]amine Formula: C12H18ClNO2S MolecularWeight: 275.79482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NCCCSC)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NCCCSC)Cl)OC

InChI

InChI=1S/C12H18ClNO2S/c1-15-11-7-9(13)10(8-12(11)16-2)14-5-4-6-17-3/h7-8,14H,4-6H2,1-3H3