1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-[(2-fluorophenyl)methyl-methyl-amino]butan-1-one

Systemtic Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-[(2-fluorophenyl)methyl-methyl-amino]butan-1-one Openeye Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-[(2-fluorophenyl)methyl-methyl-amino]butan-1-one CAS Name: 1-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-4-[(2-fluorophenyl)methyl-methylamino]-1-butanone IUPAC Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-[(2-fluorophenyl)methyl-methylamino]butan-1-one Traditional Name: 1-[4-(4-chlorophenyl)sulfonylpiperazino]-4-[(2-fluorobenzyl)-methyl-amino]butan-1-one Formula: C22H27ClFN3O3S MolecularWeight: 467.984483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3F

Isomeric SMILES

CN(CCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3F

InChI

InChI=1S/C22H27ClFN3O3S/c1-25(17-18-5-2-3-6-21(18)24)12-4-7-22(28)26-13-15-27(16-14-26)31(29,30)20-10-8-19(23)9-11-20/h2-3,5-6,8-11H,4,7,12-17H2,1H3