4-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione

Systemtic Name: 4-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione Openeye Name: 4-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-2-[1-(2-thienyl)ethyl]isoindoline-1,3-dione CAS Name: 4-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione IUPAC Name: 4-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione Traditional Name: 4-[4-(3-fluorobenzyl)piperazino]-2-[1-(2-thienyl)ethyl]isoindoline-1,3-quinone Formula: C25H24FN3O2S MolecularWeight: 449.540363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5=CC(=CC=C5)F

Isomeric SMILES

CC(C1=CC=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5=CC(=CC=C5)F

InChI

InChI=1S/C25H24FN3O2S/c1-17(22-9-4-14-32-22)29-24(30)20-7-3-8-21(23(20)25(29)31)28-12-10-27(11-13-28)16-18-5-2-6-19(26)15-18/h2-9,14-15,17H,10-13,16H2,1H3