3-(3,4-dimethylphenyl)sulfonyl-6-fluoranyl-4-(4-phenylpiperazin-1-yl)quinoline

Systemtic Name: 3-(3,4-dimethylphenyl)sulfonyl-6-fluoranyl-4-(4-phenylpiperazin-1-yl)quinoline Openeye Name: 3-(3,4-dimethylphenyl)sulfonyl-6-fluoro-4-(4-phenylpiperazin-1-yl)quinoline CAS Name: 3-(3,4-dimethylphenyl)sulfonyl-6-fluoro-4-(4-phenyl-1-piperazinyl)quinoline IUPAC Name: 3-(3,4-dimethylphenyl)sulfonyl-6-fluoro-4-(4-phenylpiperazin-1-yl)quinoline Traditional Name: 3-(3,4-dimethylphenyl)sulfonyl-6-fluoro-4-(4-phenylpiperazino)quinoline Formula: C27H26FN3O2S MolecularWeight: 475.577643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCN(CC4)C5=CC=CC=C5)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCN(CC4)C5=CC=CC=C5)F)C

InChI

InChI=1S/C27H26FN3O2S/c1-19-8-10-23(16-20(19)2)34(32,33)26-18-29-25-11-9-21(28)17-24(25)27(26)31-14-12-30(13-15-31)22-6-4-3-5-7-22/h3-11,16-18H,12-15H2,1-2H3