4-methyl-N-[2-(phenylmethylsulfanyl)undecyl]aniline

Systemtic Name: 4-methyl-N-[2-(phenylmethylsulfanyl)undecyl]aniline Openeye Name: N-(2-benzylsulfanylundecyl)-4-methyl-aniline CAS Name: 4-methyl-N-[2-(phenylmethylthio)undecyl]aniline IUPAC Name: N-(2-benzylsulfanylundecyl)-4-methylaniline Traditional Name: 2-(benzylthio)undecyl-(p-tolyl)amine Formula: C25H37NS MolecularWeight: 383.63298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CNC1=CC=C(C=C1)C)SCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCC(CNC1=CC=C(C=C1)C)SCC2=CC=CC=C2

InChI

InChI=1S/C25H37NS/c1-3-4-5-6-7-8-12-15-25(27-21-23-13-10-9-11-14-23)20-26-24-18-16-22(2)17-19-24/h9-11,13-14,16-19,25-26H,3-8,12,15,20-21H2,1-2H3