[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-(2-methylsulfonylphenyl)methanone

Systemtic Name: [4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-(2-methylsulfonylphenyl)methanone Openeye Name: [4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-(2-methylsulfonylphenyl)methanone CAS Name: [4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-(2-methylsulfonylphenyl)methanone IUPAC Name: [4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-(2-methylsulfonylphenyl)methanone Traditional Name: [4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-(2-mesylphenyl)methanone Formula: C18H18ClFN2O5S2 MolecularWeight: 460.927323

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H18ClFN2O5S2/c1-28(24,25)17-5-3-2-4-14(17)18(23)21-8-10-22(11-9-21)29(26,27)13-6-7-16(20)15(19)12-13/h2-7,12H,8-11H2,1H3