2-[[3-[2-(5-methyl-2-pyridin-4-yl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[3-[2-(5-methyl-2-pyridin-4-yl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[3-[2-[5-methyl-2-(4-pyridyl)oxazol-4-yl]ethoxy]phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[3-[2-(5-methyl-2-pyridin-4-yl-4-oxazolyl)ethoxy]phenyl]methylthio]acetic acid IUPAC Name: 2-[[3-[2-(5-methyl-2-pyridin-4-yl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[3-[2-[5-methyl-2-(4-pyridyl)oxazol-4-yl]ethoxy]benzyl]thio]acetic acid Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=NC=C2)CCOC3=CC=CC(=C3)CSCC(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=NC=C2)CCOC3=CC=CC(=C3)CSCC(=O)O

InChI

InChI=1S/C20H20N2O4S/c1-14-18(22-20(26-14)16-5-8-21-9-6-16)7-10-25-17-4-2-3-15(11-17)12-27-13-19(23)24/h2-6,8-9,11H,7,10,12-13H2,1H3,(H,23,24)