methyl 4-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NN=CN2C3=CC=CC=C3F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NN=CN2C3=CC=CC=C3F

InChI

InChI=1S/C17H14FN3O2S/c1-23-16(22)13-8-6-12(7-9-13)10-24-17-20-19-11-21(17)15-5-3-2-4-14(15)18/h2-9,11H,10H2,1H3