2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]acetic acid CAS Name: 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylthio]acetic acid IUPAC Name: 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylthio]acetic acid Formula: C8H12N2O3S MolecularWeight: 216.25748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)CSCC(=O)O

Isomeric SMILES

CC(C)C1=NOC(=N1)CSCC(=O)O

InChI

InChI=1S/C8H12N2O3S/c1-5(2)8-9-6(13-10-8)3-14-4-7(11)12/h5H,3-4H2,1-2H3,(H,11,12)