5-[(4-bromanylpyrazol-1-yl)methyl]thiophene-2-carboxylate

Systemtic Name: 5-[(4-bromanylpyrazol-1-yl)methyl]thiophene-2-carboxylate Openeye Name: 5-[(4-bromopyrazol-1-yl)methyl]thiophene-2-carboxylate CAS Name: 5-[(4-bromo-1-pyrazolyl)methyl]-2-thiophenecarboxylate IUPAC Name: 5-[(4-bromopyrazol-1-yl)methyl]thiophene-2-carboxylate Traditional Name: 5-[(4-bromopyrazol-1-yl)methyl]-2-thenoate Formula: C9H6BrN2O2S- MolecularWeight: 286.12514

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)C(=O)[O-])CN2C=C(C=N2)Br

Isomeric SMILES

C1=C(SC(=C1)C(=O)[O-])CN2C=C(C=N2)Br

InChI

InChI=1S/C9H7BrN2O2S/c10-6-3-11-12(4-6)5-7-1-2-8(15-7)9(13)14/h1-4H,5H2,(H,13,14)/p-1