2-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-methyl-amino]ethanoate

Systemtic Name: 2-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-methyl-amino]ethanoate Openeye Name: 2-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-methyl-amino]acetate CAS Name: 2-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-methylamino]acetate IUPAC Name: 2-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-methylamino]acetate Traditional Name: 2-[(3-m-anisyl-1,2,4-thiadiazol-5-yl)-methyl-amino]acetate Formula: C13H14N3O3S- MolecularWeight: 292.33356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])C1=NC(=NS1)CC2=CC(=CC=C2)OC

Isomeric SMILES

CN(CC(=O)[O-])C1=NC(=NS1)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C13H15N3O3S/c1-16(8-12(17)18)13-14-11(15-20-13)7-9-4-3-5-10(6-9)19-2/h3-6H,7-8H2,1-2H3,(H,17,18)/p-1