N-(3,4-dimethoxyphenyl)-6-fluoranyl-3-(phenylsulfonyl)quinolin-4-amine

Systemtic Name: N-(3,4-dimethoxyphenyl)-6-fluoranyl-3-(phenylsulfonyl)quinolin-4-amine Openeye Name: 3-(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)-6-fluoro-quinolin-4-amine CAS Name: 3-(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)-6-fluoro-4-quinolinamine IUPAC Name: 3-(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)-6-fluoroquinolin-4-amine Traditional Name: (3-besyl-6-fluoro-4-quinolyl)-(3,4-dimethoxyphenyl)amine Formula: C23H19FN2O4S MolecularWeight: 438.471363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=CC=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=CC=C4)F)OC

InChI

InChI=1S/C23H19FN2O4S/c1-29-20-11-9-16(13-21(20)30-2)26-23-18-12-15(24)8-10-19(18)25-14-22(23)31(27,28)17-6-4-3-5-7-17/h3-14H,1-2H3,(H,25,26)