1-(4-ethylphenyl)-5-thiophen-2-yl-pyrazole-3-carboxylate

Systemtic Name: 1-(4-ethylphenyl)-5-thiophen-2-yl-pyrazole-3-carboxylate Openeye Name: 1-(4-ethylphenyl)-5-(2-thienyl)pyrazole-3-carboxylate CAS Name: 1-(4-ethylphenyl)-5-thiophen-2-yl-3-pyrazolecarboxylate IUPAC Name: 1-(4-ethylphenyl)-5-thiophen-2-ylpyrazole-3-carboxylate Traditional Name: 1-(4-ethylphenyl)-5-(2-thienyl)pyrazole-3-carboxylate Formula: C16H13N2O2S- MolecularWeight: 297.35162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C3=CC=CS3

InChI

InChI=1S/C16H14N2O2S/c1-2-11-5-7-12(8-6-11)18-14(15-4-3-9-21-15)10-13(17-18)16(19)20/h3-10H,2H2,1H3,(H,19,20)/p-1