2-[1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[1-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-methylsulfonyl-propyl]isoindolin-1-one CAS Name: 2-[1-[4-(4-fluorophenyl)-1-piperazinyl]-4-methylsulfonyl-1-oxobutan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfonyl-1-oxobutan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[1-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-mesyl-propyl]isoindolin-1-one Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H26FN3O4S/c1-32(30,31)15-10-21(27-16-17-4-2-3-5-20(17)22(27)28)23(29)26-13-11-25(12-14-26)19-8-6-18(24)7-9-19/h2-9,21H,10-16H2,1H3