3-(3-chlorophenyl)sulfonyl-1-ethyl-6-fluoranyl-7-(4-phenylpiperazin-1-yl)quinolin-4-one

Systemtic Name: 3-(3-chlorophenyl)sulfonyl-1-ethyl-6-fluoranyl-7-(4-phenylpiperazin-1-yl)quinolin-4-one Openeye Name: 3-(3-chlorophenyl)sulfonyl-1-ethyl-6-fluoro-7-(4-phenylpiperazin-1-yl)quinolin-4-one CAS Name: 3-(3-chlorophenyl)sulfonyl-1-ethyl-6-fluoro-7-(4-phenyl-1-piperazinyl)-4-quinolinone IUPAC Name: 3-(3-chlorophenyl)sulfonyl-1-ethyl-6-fluoro-7-(4-phenylpiperazin-1-yl)quinolin-4-one Traditional Name: 3-(3-chlorophenyl)sulfonyl-1-ethyl-6-fluoro-7-(4-phenylpiperazino)-4-quinolone Formula: C27H25ClFN3O3S MolecularWeight: 526.022103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C4=CC=CC=C4)F)S(=O)(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C4=CC=CC=C4)F)S(=O)(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C27H25ClFN3O3S/c1-2-30-18-26(36(34,35)21-10-6-7-19(28)15-21)27(33)22-16-23(29)25(17-24(22)30)32-13-11-31(12-14-32)20-8-4-3-5-9-20/h3-10,15-18H,2,11-14H2,1H3