3-methylsulfanyl-5-octadecoxy-aniline

Systemtic Name: 3-methylsulfanyl-5-octadecoxy-aniline Openeye Name: 3-methylsulfanyl-5-octadecoxy-aniline CAS Name: 3-(methylthio)-5-octadecoxyaniline IUPAC Name: 3-methylsulfanyl-5-octadecoxyaniline Traditional Name: [3-(methylthio)-5-stearyloxy-phenyl]amine Formula: C25H45NOS MolecularWeight: 407.6959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)N)SC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)N)SC

InChI

InChI=1S/C25H45NOS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27-24-20-23(26)21-25(22-24)28-2/h20-22H,3-19,26H2,1-2H3