2-[4-(2-fluoranyl-5-methylsulfonyl-phenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinoline

Systemtic Name: 2-[4-(2-fluoranyl-5-methylsulfonyl-phenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinoline Openeye Name: 2-[4-(2-fluoro-5-methylsulfonyl-phenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinoline CAS Name: 2-[4-(2-fluoro-5-methylsulfonylphenyl)-1-piperazinyl]-6-(1H-pyrazol-4-yl)quinoline IUPAC Name: 2-[4-(2-fluoro-5-methylsulfonylphenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinoline Traditional Name: 2-[4-(2-fluoro-5-mesyl-phenyl)piperazino]-6-(1H-pyrazol-4-yl)quinoline Formula: C23H22FN5O2S MolecularWeight: 451.516483

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)F)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)C5=CNN=C5

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)C5=CNN=C5

InChI

InChI=1S/C23H22FN5O2S/c1-32(30,31)19-4-5-20(24)22(13-19)28-8-10-29(11-9-28)23-7-3-17-12-16(2-6-21(17)27-23)18-14-25-26-15-18/h2-7,12-15H,8-11H2,1H3,(H,25,26)