1-[(4-fluorophenyl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]piperazin-2-one

Systemtic Name: 1-[(4-fluorophenyl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]piperazin-2-one Openeye Name: 1-[(4-fluorophenyl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylacetyl]piperazin-2-one CAS Name: 1-[(4-fluorophenyl)methyl]-4-[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]-2-piperazinone IUPAC Name: 1-[(4-fluorophenyl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylacetyl]piperazin-2-one Traditional Name: 1-(4-fluorobenzyl)-4-[2-[(1-methylimidazol-2-yl)thio]acetyl]piperazin-2-one Formula: C17H19FN4O2S MolecularWeight: 362.421763

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)F

Isomeric SMILES

CN1C=CN=C1SCC(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN4O2S/c1-20-7-6-19-17(20)25-12-16(24)22-9-8-21(15(23)11-22)10-13-2-4-14(18)5-3-13/h2-7H,8-12H2,1H3