4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: 4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]benzoate IUPAC Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]benzoate Formula: C10H8N3O2S2- MolecularWeight: 266.31942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(S2)N)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(S2)N)C(=O)[O-]

InChI

InChI=1S/C10H9N3O2S2/c11-9-12-13-10(17-9)16-5-6-1-3-7(4-2-6)8(14)15/h1-4H,5H2,(H2,11,12)(H,14,15)/p-1