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

Systemtic Name: 2-[methyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]ethanoate Openeye Name: 2-[(3-benzyl-1,2,4-thiadiazol-5-yl)-methyl-amino]acetate CAS Name: 2-[methyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]acetate IUPAC Name: 2-[(3-benzyl-1,2,4-thiadiazol-5-yl)-methylamino]acetate Traditional Name: 2-[(3-benzyl-1,2,4-thiadiazol-5-yl)-methyl-amino]acetate Formula: C12H12N3O2S- MolecularWeight: 262.30758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O2S/c1-15(8-11(16)17)12-13-10(14-18-12)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,16,17)/p-1