1-(4-methylsulfanylphenyl)-3-octadecyl-urea

Systemtic Name: 1-(4-methylsulfanylphenyl)-3-octadecyl-urea Openeye Name: 1-(4-methylsulfanylphenyl)-3-octadecyl-urea CAS Name: 1-[4-(methylthio)phenyl]-3-octadecylurea IUPAC Name: 1-(4-methylsulfanylphenyl)-3-octadecylurea Traditional Name: 1-[4-(methylthio)phenyl]-3-stearyl-urea Formula: C26H46N2OS MolecularWeight: 434.72124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC=C(C=C1)SC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC=C(C=C1)SC

InChI

InChI=1S/C26H46N2OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-27-26(29)28-24-19-21-25(30-2)22-20-24/h19-22H,3-18,23H2,1-2H3,(H2,27,28,29)