quinolin-2-yl-[4-[2,3,4-tris(fluoranyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: quinolin-2-yl-[4-[2,3,4-tris(fluoranyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: 2-quinolyl-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 2-quinolinyl-[4-(2,3,4-trifluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: quinolin-2-yl-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 2-quinolyl-[4-(2,3,4-trifluorophenyl)sulfonylpiperazino]methanone Formula: C20H16F3N3O3S MolecularWeight: 435.41955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NC3=CC=CC=C3C=C2)S(=O)(=O)C4=C(C(=C(C=C4)F)F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=NC3=CC=CC=C3C=C2)S(=O)(=O)C4=C(C(=C(C=C4)F)F)F

InChI

InChI=1S/C20H16F3N3O3S/c21-14-6-8-17(19(23)18(14)22)30(28,29)26-11-9-25(10-12-26)20(27)16-7-5-13-3-1-2-4-15(13)24-16/h1-8H,9-12H2