1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C16H18ClFN4O3S2 MolecularWeight: 432.920523

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CN1C=CN=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H18ClFN4O3S2/c1-20-5-4-19-16(20)26-11-15(23)21-6-8-22(9-7-21)27(24,25)12-2-3-14(18)13(17)10-12/h2-5,10H,6-9,11H2,1H3