3-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 3-[[2-(2-thienyl)oxazol-4-yl]methylsulfanyl]propanoic acid CAS Name: 3-[(2-thiophen-2-yl-4-oxazolyl)methylthio]propanoic acid IUPAC Name: 3-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 3-[[2-(2-thienyl)oxazol-4-yl]methylthio]propionic acid Formula: C11H11NO3S2 MolecularWeight: 269.33994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=CO2)CSCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=NC(=CO2)CSCCC(=O)O

InChI

InChI=1S/C11H11NO3S2/c13-10(14)3-5-16-7-8-6-15-11(12-8)9-2-1-4-17-9/h1-2,4,6H,3,5,7H2,(H,13,14)