2-(4-methylsulfanylphenoxy)-3-[4-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]phenyl]propanoate

Systemtic Name: 2-(4-methylsulfanylphenoxy)-3-[4-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]phenyl]propanoate Openeye Name: 2-(4-methylsulfanylphenoxy)-3-[4-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]phenyl]propanoate CAS Name: 2-[4-(methylthio)phenoxy]-3-[4-[2-[[oxo-[4-(2-pyridinyl)phenyl]methyl]amino]ethoxy]phenyl]propanoate IUPAC Name: 2-(4-methylsulfanylphenoxy)-3-[4-[2-[(4-pyridin-2-ylbenzoyl)amino]ethoxy]phenyl]propanoate Traditional Name: 2-[4-(methylthio)phenoxy]-3-[4-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]phenyl]propionate Formula: C30H27N2O5S- MolecularWeight: 527.61078

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC(CC2=CC=C(C=C2)OCCNC(=O)C3=CC=C(C=C3)C4=CC=CC=N4)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)OC(CC2=CC=C(C=C2)OCCNC(=O)C3=CC=C(C=C3)C4=CC=CC=N4)C(=O)[O-]

InChI

InChI=1S/C30H28N2O5S/c1-38-26-15-13-25(14-16-26)37-28(30(34)35)20-21-5-11-24(12-6-21)36-19-18-32-29(33)23-9-7-22(8-10-23)27-4-2-3-17-31-27/h2-17,28H,18-20H2,1H3,(H,32,33)(H,34,35)/p-1