5-[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione Openeye Name: 5-[4-[[5-(2-fluorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[[4-[[5-(2-fluorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-oxomethyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazine-1-carbonyl]-2-methylisoindole-1,3-dione Traditional Name: 5-[4-[[5-(2-fluorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]-2-methyl-isoindoline-1,3-quinone Formula: C25H22FN3O3S MolecularWeight: 463.523883

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5F

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5F

InChI

InChI=1S/C25H22FN3O3S/c1-27-24(31)18-8-6-16(14-20(18)25(27)32)23(30)29-12-10-28(11-13-29)15-17-7-9-22(33-17)19-4-2-3-5-21(19)26/h2-9,14H,10-13,15H2,1H3