(2-fluorophenyl)methyl 4-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (2-fluorophenyl)methyl 4-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (2-fluorophenyl)methyl 4-(5-methylsulfanyltetrazol-1-yl)benzoate CAS Name: 4-[5-(methylthio)-1-tetrazolyl]benzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 4-(5-methylsulfanyltetrazol-1-yl)benzoate Traditional Name: 4-[5-(methylthio)tetrazol-1-yl]benzoic acid (2-fluorobenzyl) ester Formula: C16H13FN4O2S MolecularWeight: 344.363423

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=NN1C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3F

Isomeric SMILES

CSC1=NN=NN1C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3F

InChI

InChI=1S/C16H13FN4O2S/c1-24-16-18-19-20-21(16)13-8-6-11(7-9-13)15(22)23-10-12-4-2-3-5-14(12)17/h2-9H,10H2,1H3