(4-bromophenyl)methyl 2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (4-bromophenyl)methyl 2-[5-(2-thienyl)tetrazol-2-yl]acetate CAS Name: 2-(5-thiophen-2-yl-2-tetrazolyl)acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(5-thiophen-2-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(2-thienyl)tetrazol-2-yl]acetic acid (4-bromobenzyl) ester Formula: C14H11BrN4O2S MolecularWeight: 379.23174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11BrN4O2S/c15-11-5-3-10(4-6-11)9-21-13(20)8-19-17-14(16-18-19)12-2-1-7-22-12/h1-7H,8-9H2