2-methyl-2-[[5-(phenylmethyl)-1,2,3-thiadiazol-4-yl]sulfanyl]propanoic acid

Systemtic Name: 2-methyl-2-[[5-(phenylmethyl)-1,2,3-thiadiazol-4-yl]sulfanyl]propanoic acid Openeye Name: 2-(5-benzylthiadiazol-4-yl)sulfanyl-2-methyl-propanoic acid CAS Name: 2-methyl-2-[[5-(phenylmethyl)-4-thiadiazolyl]thio]propanoic acid IUPAC Name: 2-(5-benzylthiadiazol-4-yl)sulfanyl-2-methylpropanoic acid Traditional Name: 2-[(5-benzylthiadiazol-4-yl)thio]-2-methyl-propionic acid Formula: C13H14N2O2S2 MolecularWeight: 294.39246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SC1=C(SN=N1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C(=O)O)SC1=C(SN=N1)CC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S2/c1-13(2,12(16)17)18-11-10(19-15-14-11)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,16,17)