1-thiophen-2-yl-4-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-thiophen-2-yl-4-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-(2-thienyl)-4-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]butane-1,4-dione CAS Name: 1-[4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-thiophen-2-yl-4-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(2-thienyl)-4-[4-[3-(trifluoromethyl)benzoyl]piperazino]butane-1,4-dione Formula: C20H19F3N2O3S MolecularWeight: 424.43667

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=CS2)C(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=CS2)C(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H19F3N2O3S/c21-20(22,23)15-4-1-3-14(13-15)19(28)25-10-8-24(9-11-25)18(27)7-6-16(26)17-5-2-12-29-17/h1-5,12-13H,6-11H2