N-[(3-dodecylsulfanylpropanoylamino)methyl]-4-oxidanyl-benzamide

Systemtic Name: N-[(3-dodecylsulfanylpropanoylamino)methyl]-4-oxidanyl-benzamide Openeye Name: N-[(3-dodecylsulfanylpropanoylamino)methyl]-4-hydroxy-benzamide CAS Name: N-[[[3-(dodecylthio)-1-oxopropyl]amino]methyl]-4-hydroxybenzamide IUPAC Name: N-[(3-dodecylsulfanylpropanoylamino)methyl]-4-hydroxybenzamide Traditional Name: 4-hydroxy-N-[[3-(laurylthio)propanoylamino]methyl]benzamide Formula: C23H38N2O3S MolecularWeight: 422.62442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCC(=O)NCNC(=O)C1=CC=C(C=C1)O

Isomeric SMILES

CCCCCCCCCCCCSCCC(=O)NCNC(=O)C1=CC=C(C=C1)O

InChI

InChI=1S/C23H38N2O3S/c1-2-3-4-5-6-7-8-9-10-11-17-29-18-16-22(27)24-19-25-23(28)20-12-14-21(26)15-13-20/h12-15,26H,2-11,16-19H2,1H3,(H,24,27)(H,25,28)