3-azanyl-1-[2-(4-hydroxyphenyl)sulfanylethyl]-1-octadecyl-urea

Systemtic Name: 3-azanyl-1-[2-(4-hydroxyphenyl)sulfanylethyl]-1-octadecyl-urea Openeye Name: 3-amino-1-[2-(4-hydroxyphenyl)sulfanylethyl]-1-octadecyl-urea CAS Name: 3-amino-1-[2-[(4-hydroxyphenyl)thio]ethyl]-1-octadecylurea IUPAC Name: 3-amino-1-[2-(4-hydroxyphenyl)sulfanylethyl]-1-octadecylurea Traditional Name: 3-amino-1-[2-[(4-hydroxyphenyl)thio]ethyl]-1-stearyl-urea Formula: C27H49N3O2S MolecularWeight: 479.76186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCSC1=CC=C(C=C1)O)C(=O)NN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCSC1=CC=C(C=C1)O)C(=O)NN

InChI

InChI=1S/C27H49N3O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30(27(32)29-28)23-24-33-26-20-18-25(31)19-21-26/h18-21,31H,2-17,22-24,28H2,1H3,(H,29,32)