3-(4-hydroxyphenyl)sulfanyl-N-[(octadecylcarbamoylamino)methyl]propanamide

Systemtic Name: 3-(4-hydroxyphenyl)sulfanyl-N-[(octadecylcarbamoylamino)methyl]propanamide Openeye Name: 3-(4-hydroxyphenyl)sulfanyl-N-[(octadecylcarbamoylamino)methyl]propanamide CAS Name: 3-[(4-hydroxyphenyl)thio]-N-[[[(octadecylamino)-oxomethyl]amino]methyl]propanamide IUPAC Name: 3-(4-hydroxyphenyl)sulfanyl-N-[(octadecylcarbamoylamino)methyl]propanamide Traditional Name: 3-[(4-hydroxyphenyl)thio]-N-[(stearylcarbamoylamino)methyl]propionamide Formula: C29H51N3O3S MolecularWeight: 521.79854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NCNC(=O)CCSC1=CC=C(C=C1)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NCNC(=O)CCSC1=CC=C(C=C1)O

InChI

InChI=1S/C29H51N3O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-30-29(35)32-25-31-28(34)22-24-36-27-20-18-26(33)19-21-27/h18-21,33H,2-17,22-25H2,1H3,(H,31,34)(H2,30,32,35)