2,2,2-tris(fluoranyl)-1-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidin-5-yl]ethanone

Systemtic Name: 2,2,2-tris(fluoranyl)-1-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidin-5-yl]ethanone Openeye Name: 2,2,2-trifluoro-1-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]pyrimidin-5-yl]ethanone CAS Name: 2,2,2-trifluoro-1-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-5-pyrimidinyl]ethanone IUPAC Name: 2,2,2-trifluoro-1-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidin-5-yl]ethanone Traditional Name: 2,2,2-trifluoro-1-[2-[4-(2-naphthylsulfonyl)piperazino]pyrimidin-5-yl]ethanone Formula: C20H17F3N4O3S MolecularWeight: 450.43419

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)C(=O)C(F)(F)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)C(=O)C(F)(F)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H17F3N4O3S/c21-20(22,23)18(28)16-12-24-19(25-13-16)26-7-9-27(10-8-26)31(29,30)17-6-5-14-3-1-2-4-15(14)11-17/h1-6,11-13H,7-10H2