2-[5-(5-azanyl-1,3,4-thiadiazol-2-yl)-1-methyl-imidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[5-(5-azanyl-1,3,4-thiadiazol-2-yl)-1-methyl-imidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[5-(5-amino-1,3,4-thiadiazol-2-yl)-1-methyl-imidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[5-(5-amino-1,3,4-thiadiazol-2-yl)-1-methyl-2-imidazolyl]thio]acetic acid IUPAC Name: 2-[5-(5-amino-1,3,4-thiadiazol-2-yl)-1-methylimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[5-(5-amino-1,3,4-thiadiazol-2-yl)-1-methyl-imidazol-2-yl]thio]acetic acid Formula: C8H9N5O2S2 MolecularWeight: 271.31936

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)O)C2=NN=C(S2)N

Isomeric SMILES

CN1C(=CN=C1SCC(=O)O)C2=NN=C(S2)N

InChI

InChI=1S/C8H9N5O2S2/c1-13-4(6-11-12-7(9)17-6)2-10-8(13)16-3-5(14)15/h2H,3H2,1H3,(H2,9,12)(H,14,15)