(4-bromanyl-2-fluoranyl-phenyl)methyl 2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-[5-(2-thienyl)tetrazol-2-yl]acetate CAS Name: 2-(5-thiophen-2-yl-2-tetrazolyl)acetic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-(5-thiophen-2-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(2-thienyl)tetrazol-2-yl]acetic acid (4-bromo-2-fluoro-benzyl) ester Formula: C14H10BrFN4O2S MolecularWeight: 397.222203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN(N=N2)CC(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CSC(=C1)C2=NN(N=N2)CC(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C14H10BrFN4O2S/c15-10-4-3-9(11(16)6-10)8-22-13(21)7-20-18-14(17-19-20)12-2-1-5-23-12/h1-6H,7-8H2