2-[4-(4-hydroxyphenyl)sulfanylphenyl]-N'-octadecyl-propanediamide

Systemtic Name: 2-[4-(4-hydroxyphenyl)sulfanylphenyl]-N'-octadecyl-propanediamide Openeye Name: 2-[4-(4-hydroxyphenyl)sulfanylphenyl]-N'-octadecyl-propanediamide CAS Name: 2-[4-[(4-hydroxyphenyl)thio]phenyl]-N'-octadecylpropanediamide IUPAC Name: 2-[4-(4-hydroxyphenyl)sulfanylphenyl]-N'-octadecylpropanediamide Traditional Name: 2-[4-[(4-hydroxyphenyl)thio]phenyl]-N'-stearyl-malonamide Formula: C33H50N2O3S MolecularWeight: 554.8267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(C1=CC=C(C=C1)SC2=CC=C(C=C2)O)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(C1=CC=C(C=C1)SC2=CC=C(C=C2)O)C(=O)N

InChI

InChI=1S/C33H50N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-35-33(38)31(32(34)37)27-18-22-29(23-19-27)39-30-24-20-28(36)21-25-30/h18-25,31,36H,2-17,26H2,1H3,(H2,34,37)(H,35,38)