2-azanyl-3-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propylsulfanyl]propanoic acid CAS Name: 2-amino-3-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propylthio]propanoic acid IUPAC Name: 2-amino-3-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propylthio]propionic acid Formula: C12H15N3O3S2 MolecularWeight: 313.3958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NOC(=N2)CCCSCC(C(=O)O)N

Isomeric SMILES

C1=CSC(=C1)C2=NOC(=N2)CCCSCC(C(=O)O)N

InChI

InChI=1S/C12H15N3O3S2/c13-8(12(16)17)7-19-5-2-4-10-14-11(15-18-10)9-3-1-6-20-9/h1,3,6,8H,2,4-5,7,13H2,(H,16,17)