[5-(2-bromanylthiophen-3-yl)-1,2,3,4-tetrazol-1-yl] propanoate

Systemtic Name: [5-(2-bromanylthiophen-3-yl)-1,2,3,4-tetrazol-1-yl] propanoate Openeye Name: [5-(2-bromo-3-thienyl)tetrazol-1-yl] propanoate CAS Name: propanoic acid [5-(2-bromo-3-thiophenyl)-1-tetrazolyl] ester IUPAC Name: [5-(2-bromothiophen-3-yl)tetrazol-1-yl] propanoate Traditional Name: propionic acid [5-(2-bromo-3-thienyl)tetrazol-1-yl] ester Formula: C8H7BrN4O2S MolecularWeight: 303.13578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON1C(=NN=N1)C2=C(SC=C2)Br

Isomeric SMILES

CCC(=O)ON1C(=NN=N1)C2=C(SC=C2)Br

InChI

InChI=1S/C8H7BrN4O2S/c1-2-6(14)15-13-8(10-11-12-13)5-3-4-16-7(5)9/h3-4H,2H2,1H3