1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(4-ethanoyl-2-fluoranyl-phenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(4-ethanoyl-2-fluoranyl-phenyl)sulfanyl-ethanone Openeye Name: 2-(4-acetyl-2-fluoro-phenyl)sulfanyl-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]ethanone CAS Name: 2-[(4-acetyl-2-fluorophenyl)thio]-1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-acetyl-2-fluorophenyl)sulfanyl-1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(4-acetyl-2-fluoro-phenyl)thio]-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]ethanone Formula: C18H18ClFN2O4S3 MolecularWeight: 476.992923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)F

InChI

InChI=1S/C18H18ClFN2O4S3/c1-12(23)13-2-3-15(14(20)10-13)27-11-17(24)21-6-8-22(9-7-21)29(25,26)18-5-4-16(19)28-18/h2-5,10H,6-9,11H2,1H3