2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate

Systemtic Name: 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate Openeye Name: 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate CAS Name: benzoic acid 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]ethyl ester IUPAC Name: 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate Traditional Name: benzoic acid 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]ethyl ester Formula: C17H14FN3O2S MolecularWeight: 343.375363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCSC2=NN=CN2C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCSC2=NN=CN2C3=CC=CC=C3F

InChI

InChI=1S/C17H14FN3O2S/c18-14-8-4-5-9-15(14)21-12-19-20-17(21)24-11-10-23-16(22)13-6-2-1-3-7-13/h1-9,12H,10-11H2