[2-(4-fluorophenyl)quinolin-4-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: [2-(4-fluorophenyl)quinolin-4-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-[2-(4-fluorophenyl)-4-quinolyl]methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[2-(4-fluorophenyl)-4-quinolinyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[2-(4-fluorophenyl)quinolin-4-yl]methanone Traditional Name: (4-besylpiperazino)-[2-(4-fluorophenyl)-4-quinolyl]methanone Formula: C26H22FN3O3S MolecularWeight: 475.534583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H22FN3O3S/c27-20-12-10-19(11-13-20)25-18-23(22-8-4-5-9-24(22)28-25)26(31)29-14-16-30(17-15-29)34(32,33)21-6-2-1-3-7-21/h1-13,18H,14-17H2