N-[[aminocarbonyl-[2-(4-hydroxyphenyl)sulfanylethyl]amino]methyl]octadecanamide

Systemtic Name: N-[[aminocarbonyl-[2-(4-hydroxyphenyl)sulfanylethyl]amino]methyl]octadecanamide Openeye Name: N-[[carbamoyl-[2-(4-hydroxyphenyl)sulfanylethyl]amino]methyl]octadecanamide CAS Name: N-[[carbamoyl-[2-[(4-hydroxyphenyl)thio]ethyl]amino]methyl]octadecanamide IUPAC Name: N-[[carbamoyl-[2-(4-hydroxyphenyl)sulfanylethyl]amino]methyl]octadecanamide Traditional Name: N-[[carbamoyl-[2-[(4-hydroxyphenyl)thio]ethyl]amino]methyl]stearamide Formula: C28H49N3O3S MolecularWeight: 507.77196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCN(CCSC1=CC=C(C=C1)O)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCN(CCSC1=CC=C(C=C1)O)C(=O)N

InChI

InChI=1S/C28H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27(33)30-24-31(28(29)34)22-23-35-26-20-18-25(32)19-21-26/h18-21,32H,2-17,22-24H2,1H3,(H2,29,34)(H,30,33)