[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone

Systemtic Name: [4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone Openeye Name: [4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone CAS Name: [4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-(3,5-dimethoxy-4-methylphenyl)methanone IUPAC Name: [4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-(3,5-dimethoxy-4-methylphenyl)methanone Traditional Name: [4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-(3,5-dimethoxy-4-methyl-phenyl)methanone Formula: C20H22ClFN2O5S MolecularWeight: 456.915483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl)OC

InChI

InChI=1S/C20H22ClFN2O5S/c1-13-18(28-2)10-14(11-19(13)29-3)20(25)23-6-8-24(9-7-23)30(26,27)15-4-5-17(22)16(21)12-15/h4-5,10-12H,6-9H2,1-3H3