[6-(phenylmethylsulfanyl)pyrazin-2-yl] ethanoate

Systemtic Name: [6-(phenylmethylsulfanyl)pyrazin-2-yl] ethanoate Openeye Name: (6-benzylsulfanylpyrazin-2-yl) acetate CAS Name: acetic acid [6-(phenylmethylthio)-2-pyrazinyl] ester IUPAC Name: (6-benzylsulfanylpyrazin-2-yl) acetate Traditional Name: acetic acid [6-(benzylthio)pyrazin-2-yl] ester Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CN=CC(=N1)SCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1=CN=CC(=N1)SCC2=CC=CC=C2

InChI

InChI=1S/C13H12N2O2S/c1-10(16)17-12-7-14-8-13(15-12)18-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3