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

Systemtic Name: 2-[[3-[2-(2-ethyl-5-methyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[3-[2-(2-ethyl-5-methyl-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[3-[2-(2-ethyl-5-methyl-4-oxazolyl)ethoxy]phenyl]methylthio]acetic acid IUPAC Name: 2-[[3-[2-(2-ethyl-5-methyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[3-[2-(2-ethyl-5-methyl-oxazol-4-yl)ethoxy]benzyl]thio]acetic acid Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(O1)C)CCOC2=CC=CC(=C2)CSCC(=O)O

Isomeric SMILES

CCC1=NC(=C(O1)C)CCOC2=CC=CC(=C2)CSCC(=O)O

InChI

InChI=1S/C17H21NO4S/c1-3-16-18-15(12(2)22-16)7-8-21-14-6-4-5-13(9-14)10-23-11-17(19)20/h4-6,9H,3,7-8,10-11H2,1-2H3,(H,19,20)