2-[5-methoxy-2-methyl-4-[3-[(5-phenylpyridin-2-yl)amino]propylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-4-[3-[(5-phenylpyridin-2-yl)amino]propylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-4-[3-[(5-phenyl-2-pyridyl)amino]propylsulfanyl]phenoxy]acetic acid CAS Name: 2-[5-methoxy-2-methyl-4-[3-[(5-phenyl-2-pyridinyl)amino]propylthio]phenoxy]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-4-[3-[(5-phenylpyridin-2-yl)amino]propylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[5-methoxy-2-methyl-4-[3-[(5-phenyl-2-pyridyl)amino]propylthio]phenoxy]acetic acid Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC(=O)O)OC)SCCCNC2=NC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1OCC(=O)O)OC)SCCCNC2=NC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4S/c1-17-13-22(21(29-2)14-20(17)30-16-24(27)28)31-12-6-11-25-23-10-9-19(15-26-23)18-7-4-3-5-8-18/h3-5,7-10,13-15H,6,11-12,16H2,1-2H3,(H,25,26)(H,27,28)