3-[[4-[2-(2-methylsulfanylphenyl)ethanoyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one

Systemtic Name: 3-[[4-[2-(2-methylsulfanylphenyl)ethanoyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[4-[2-(2-methylsulfanylphenyl)acetyl]-1-piperidyl]methyl]-1H-pyrazin-2-one CAS Name: 3-[[4-[2-[2-(methylthio)phenyl]-1-oxoethyl]-1-piperidinyl]methyl]-1H-pyrazin-2-one IUPAC Name: 3-[[4-[2-(2-methylsulfanylphenyl)acetyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Traditional Name: 3-[[4-[2-[2-(methylthio)phenyl]acetyl]piperidino]methyl]-1H-pyrazin-2-one Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1CC(=O)C2CCN(CC2)CC3=NC=CNC3=O

Isomeric SMILES

CSC1=CC=CC=C1CC(=O)C2CCN(CC2)CC3=NC=CNC3=O

InChI

InChI=1S/C19H23N3O2S/c1-25-18-5-3-2-4-15(18)12-17(23)14-6-10-22(11-7-14)13-16-19(24)21-9-8-20-16/h2-5,8-9,14H,6-7,10-13H2,1H3,(H,21,24)