6-fluoranyl-4-[4-(4-fluorophenyl)piperazin-1-yl]-3-(phenylsulfonyl)quinoline

Systemtic Name: 6-fluoranyl-4-[4-(4-fluorophenyl)piperazin-1-yl]-3-(phenylsulfonyl)quinoline Openeye Name: 3-(benzenesulfonyl)-6-fluoro-4-[4-(4-fluorophenyl)piperazin-1-yl]quinoline CAS Name: 3-(benzenesulfonyl)-6-fluoro-4-[4-(4-fluorophenyl)-1-piperazinyl]quinoline IUPAC Name: 3-(benzenesulfonyl)-6-fluoro-4-[4-(4-fluorophenyl)piperazin-1-yl]quinoline Traditional Name: 3-besyl-6-fluoro-4-[4-(4-fluorophenyl)piperazino]quinoline Formula: C25H21F2N3O2S MolecularWeight: 465.514946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=C4C=C(C=CC4=NC=C3S(=O)(=O)C5=CC=CC=C5)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=C4C=C(C=CC4=NC=C3S(=O)(=O)C5=CC=CC=C5)F

InChI

InChI=1S/C25H21F2N3O2S/c26-18-6-9-20(10-7-18)29-12-14-30(15-13-29)25-22-16-19(27)8-11-23(22)28-17-24(25)33(31,32)21-4-2-1-3-5-21/h1-11,16-17H,12-15H2