N-(3-methyl-4-methylsulfanyl-phenyl)-2-[methyl-(4-octadecoxyphenyl)amino]ethanamide

Systemtic Name: N-(3-methyl-4-methylsulfanyl-phenyl)-2-[methyl-(4-octadecoxyphenyl)amino]ethanamide Openeye Name: N-(3-methyl-4-methylsulfanyl-phenyl)-2-(N-methyl-4-octadecoxy-anilino)acetamide CAS Name: N-[3-methyl-4-(methylthio)phenyl]-2-(N-methyl-4-octadecoxyanilino)acetamide IUPAC Name: N-(3-methyl-4-methylsulfanylphenyl)-2-(N-methyl-4-octadecoxyanilino)acetamide Traditional Name: N-[3-methyl-4-(methylthio)phenyl]-2-(N-methyl-4-stearyloxy-anilino)acetamide Formula: C35H56N2O2S MolecularWeight: 568.89634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)N(C)CC(=O)NC2=CC(=C(C=C2)SC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)N(C)CC(=O)NC2=CC(=C(C=C2)SC)C

InChI

InChI=1S/C35H56N2O2S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27-39-33-24-22-32(23-25-33)37(3)29-35(38)36-31-21-26-34(40-4)30(2)28-31/h21-26,28H,5-20,27,29H2,1-4H3,(H,36,38)