1-ethyl-3-(phenylmethylsulfanyl)pyrazin-2-one

Systemtic Name: 1-ethyl-3-(phenylmethylsulfanyl)pyrazin-2-one Openeye Name: 3-benzylsulfanyl-1-ethyl-pyrazin-2-one CAS Name: 1-ethyl-3-(phenylmethylthio)-2-pyrazinone IUPAC Name: 3-benzylsulfanyl-1-ethylpyrazin-2-one Traditional Name: 3-(benzylthio)-1-ethyl-pyrazin-2-one Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C(C1=O)SCC2=CC=CC=C2

Isomeric SMILES

CCN1C=CN=C(C1=O)SCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2OS/c1-2-15-9-8-14-12(13(15)16)17-10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3