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

Systemtic Name: 4-[[5-[(2-fluorophenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate Openeye Name: 4-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzoate IUPAC Name: 4-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzoate Formula: C16H11FN3O2S2- MolecularWeight: 360.405843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)C(=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)C(=O)[O-])F

InChI

InChI=1S/C16H12FN3O2S2/c17-12-3-1-2-4-13(12)18-15-19-20-16(24-15)23-9-10-5-7-11(8-6-10)14(21)22/h1-8H,9H2,(H,18,19)(H,21,22)/p-1