2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid Openeye Name: 2-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoic acid CAS Name: 2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methylthio]propanoic acid IUPAC Name: 2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid Traditional Name: 2-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methylthio]propionic acid Formula: C10H16N2O3S MolecularWeight: 244.31064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)CSC(C)C(=O)O

Isomeric SMILES

CC(C)CC1=NOC(=N1)CSC(C)C(=O)O

InChI

InChI=1S/C10H16N2O3S/c1-6(2)4-8-11-9(15-12-8)5-16-7(3)10(13)14/h6-7H,4-5H2,1-3H3,(H,13,14)