(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[6-(trifluoromethyl)pyridin-3-yl]methanone

Systemtic Name: (4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[6-(trifluoromethyl)pyridin-3-yl]methanone Openeye Name: [4-(2-naphthylsulfonyl)piperazin-1-yl]-[6-(trifluoromethyl)-3-pyridyl]methanone CAS Name: [4-(2-naphthalenylsulfonyl)-1-piperazinyl]-[6-(trifluoromethyl)-3-pyridinyl]methanone IUPAC Name: (4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[6-(trifluoromethyl)pyridin-3-yl]methanone Traditional Name: [4-(2-naphthylsulfonyl)piperazino]-[6-(trifluoromethyl)-3-pyridyl]methanone Formula: C21H18F3N3O3S MolecularWeight: 449.44613

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18F3N3O3S/c22-21(23,24)19-8-6-17(14-25-19)20(28)26-9-11-27(12-10-26)31(29,30)18-7-5-15-3-1-2-4-16(15)13-18/h1-8,13-14H,9-12H2