methyl 1-(3-bromophenyl)-5-thiophen-2-yl-pyrazole-3-carboxylate

Systemtic Name: methyl 1-(3-bromophenyl)-5-thiophen-2-yl-pyrazole-3-carboxylate Openeye Name: methyl 1-(3-bromophenyl)-5-(2-thienyl)pyrazole-3-carboxylate CAS Name: 1-(3-bromophenyl)-5-thiophen-2-yl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromophenyl)-5-thiophen-2-ylpyrazole-3-carboxylate Traditional Name: 1-(3-bromophenyl)-5-(2-thienyl)pyrazole-3-carboxylic acid methyl ester Formula: C15H11BrN2O2S MolecularWeight: 363.22904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=C1)C2=CC=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)C1=NN(C(=C1)C2=CC=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C15H11BrN2O2S/c1-20-15(19)12-9-13(14-6-3-7-21-14)18(17-12)11-5-2-4-10(16)8-11/h2-9H,1H3