1-[3-[3-methylsulfanylpropyl(phenethyl)amino]propyl]-3-(2-phenylphenyl)urea

Systemtic Name: 1-[3-[3-methylsulfanylpropyl(phenethyl)amino]propyl]-3-(2-phenylphenyl)urea Openeye Name: 1-[3-[3-methylsulfanylpropyl(phenethyl)amino]propyl]-3-(2-phenylphenyl)urea CAS Name: 1-[3-[3-(methylthio)propyl-phenethylamino]propyl]-3-(2-phenylphenyl)urea IUPAC Name: 1-[3-[3-methylsulfanylpropyl(phenethyl)amino]propyl]-3-(2-phenylphenyl)urea Traditional Name: 1-[3-[3-(methylthio)propyl-phenethyl-amino]propyl]-3-(2-phenylphenyl)urea Formula: C28H35N3OS MolecularWeight: 461.662

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCN(CCCNC(=O)NC1=CC=CC=C1C2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

CSCCCN(CCCNC(=O)NC1=CC=CC=C1C2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C28H35N3OS/c1-33-23-11-21-31(22-18-24-12-4-2-5-13-24)20-10-19-29-28(32)30-27-17-9-8-16-26(27)25-14-6-3-7-15-25/h2-9,12-17H,10-11,18-23H2,1H3,(H2,29,30,32)