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

Systemtic Name: 2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]acetic acid CAS Name: 2-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methylthio]acetic acid IUPAC Name: 2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]acetic acid Traditional Name: 2-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]acetic acid Formula: C9H8N2O3S2 MolecularWeight: 256.30142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C2=NOC(=N2)CSCC(=O)O

Isomeric SMILES

C1=CSC=C1C2=NOC(=N2)CSCC(=O)O

InChI

InChI=1S/C9H8N2O3S2/c12-8(13)5-16-4-7-10-9(11-14-7)6-1-2-15-3-6/h1-3H,4-5H2,(H,12,13)