1-(3-bromophenyl)-5-thiophen-2-yl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-bromophenyl)-5-thiophen-2-yl-pyrazole-3-carboxylic acid Openeye Name: 1-(3-bromophenyl)-5-(2-thienyl)pyrazole-3-carboxylic acid CAS Name: 1-(3-bromophenyl)-5-thiophen-2-yl-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid Traditional Name: 1-(3-bromophenyl)-5-(2-thienyl)pyrazole-3-carboxylic acid Formula: C14H9BrN2O2S MolecularWeight: 349.20246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C(=CC(=N2)C(=O)O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C(=CC(=N2)C(=O)O)C3=CC=CS3

InChI

InChI=1S/C14H9BrN2O2S/c15-9-3-1-4-10(7-9)17-12(13-5-2-6-20-13)8-11(16-17)14(18)19/h1-8H,(H,18,19)