N-[2-(2-methylphenyl)sulfanylethyl]octadecanamide

Systemtic Name: N-[2-(2-methylphenyl)sulfanylethyl]octadecanamide Openeye Name: N-[2-(o-tolylsulfanyl)ethyl]octadecanamide CAS Name: N-[2-[(2-methylphenyl)thio]ethyl]octadecanamide IUPAC Name: N-[2-(2-methylphenyl)sulfanylethyl]octadecanamide Traditional Name: N-[2-(o-tolylthio)ethyl]stearamide Formula: C27H47NOS MolecularWeight: 433.73318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCSC1=CC=CC=C1C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCSC1=CC=CC=C1C

InChI

InChI=1S/C27H47NOS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-27(29)28-23-24-30-26-21-19-18-20-25(26)2/h18-21H,3-17,22-24H2,1-2H3,(H,28,29)