3-[3-(4-fluorophenyl)-5-sulfanidyl-1,2,4-triazol-4-yl]propanoate

Systemtic Name: 3-[3-(4-fluorophenyl)-5-sulfanidyl-1,2,4-triazol-4-yl]propanoate Openeye Name: 3-[3-(4-fluorophenyl)-5-sulfido-1,2,4-triazol-4-yl]propanoate CAS Name: 3-[3-(4-fluorophenyl)-5-sulfido-1,2,4-triazol-4-yl]propanoate IUPAC Name: 3-[3-(4-fluorophenyl)-5-sulfido-1,2,4-triazol-4-yl]propanoate Traditional Name: 3-[3-(4-fluorophenyl)-5-sulfido-1,2,4-triazol-4-yl]propionate Formula: C11H8FN3O2S-2 MolecularWeight: 265.263523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(N2CCC(=O)[O-])[S-])F

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(N2CCC(=O)[O-])[S-])F

InChI

InChI=1S/C11H10FN3O2S/c12-8-3-1-7(2-4-8)10-13-14-11(18)15(10)6-5-9(16)17/h1-4H,5-6H2,(H,14,18)(H,16,17)/p-2