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

Systemtic Name: 2-[[3-[2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[3-[2-[5-methyl-2-(3-pyridyl)oxazol-4-yl]ethoxy]phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[3-[2-[5-methyl-2-(3-pyridinyl)-4-oxazolyl]ethoxy]phenyl]methylthio]acetic acid IUPAC Name: 2-[[3-[2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[3-[2-[5-methyl-2-(3-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=CN=CC=C2)CCOC3=CC=CC(=C3)CSCC(=O)O

Isomeric SMILES

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

InChI

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