2-[6-[3-(1H-pyrazol-5-yl)phenyl]pyrazin-2-yl]sulfanylethanoate

Systemtic Name: 2-[6-[3-(1H-pyrazol-5-yl)phenyl]pyrazin-2-yl]sulfanylethanoate Openeye Name: 2-[6-[3-(1H-pyrazol-5-yl)phenyl]pyrazin-2-yl]sulfanylacetate CAS Name: 2-[[6-[3-(1H-pyrazol-5-yl)phenyl]-2-pyrazinyl]thio]acetate IUPAC Name: 2-[6-[3-(1H-pyrazol-5-yl)phenyl]pyrazin-2-yl]sulfanylacetate Traditional Name: 2-[[6-[3-(1H-pyrazol-5-yl)phenyl]pyrazin-2-yl]thio]acetate Formula: C15H11N4O2S- MolecularWeight: 311.33844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CC=NN2)C3=CN=CC(=N3)SCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C2=CC=NN2)C3=CN=CC(=N3)SCC(=O)[O-]

InChI

InChI=1S/C15H12N4O2S/c20-15(21)9-22-14-8-16-7-13(18-14)11-3-1-2-10(6-11)12-4-5-17-19-12/h1-8H,9H2,(H,17,19)(H,20,21)/p-1