2-[4-[2-[ethyl-(4-phenylphenyl)amino]ethylsulfanyl]phenoxy]propanoic acid

Systemtic Name: 2-[4-[2-[ethyl-(4-phenylphenyl)amino]ethylsulfanyl]phenoxy]propanoic acid Openeye Name: 2-[4-[2-(N-ethyl-4-phenyl-anilino)ethylsulfanyl]phenoxy]propanoic acid CAS Name: 2-[4-[2-(N-ethyl-4-phenylanilino)ethylthio]phenoxy]propanoic acid IUPAC Name: 2-[4-[2-(N-ethyl-4-phenylanilino)ethylsulfanyl]phenoxy]propanoic acid Traditional Name: 2-[4-[2-(N-ethyl-4-phenyl-anilino)ethylthio]phenoxy]propionic acid Formula: C25H27NO3S MolecularWeight: 421.55178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCSC1=CC=C(C=C1)OC(C)C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CCSC1=CC=C(C=C1)OC(C)C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H27NO3S/c1-3-26(22-11-9-21(10-12-22)20-7-5-4-6-8-20)17-18-30-24-15-13-23(14-16-24)29-19(2)25(27)28/h4-16,19H,3,17-18H2,1-2H3,(H,27,28)