3-methylsulfanyl-N-octyl-aniline

Systemtic Name: 3-methylsulfanyl-N-octyl-aniline Openeye Name: 3-methylsulfanyl-N-octyl-aniline CAS Name: 3-(methylthio)-N-octylaniline IUPAC Name: 3-methylsulfanyl-N-octylaniline Traditional Name: [3-(methylthio)phenyl]-octyl-amine Formula: C15H25NS MolecularWeight: 251.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC(=CC=C1)SC

Isomeric SMILES

CCCCCCCCNC1=CC(=CC=C1)SC

InChI

InChI=1S/C15H25NS/c1-3-4-5-6-7-8-12-16-14-10-9-11-15(13-14)17-2/h9-11,13,16H,3-8,12H2,1-2H3