2-(4-fluorophenyl)-N-[3-[methyl(methylsulfonyl)amino]propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-[3-[methyl(methylsulfonyl)amino]propyl]quinoline-4-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-[3-[methyl(methylsulfonyl)amino]propyl]quinoline-4-carboxamide CAS Name: 2-(4-fluorophenyl)-N-[3-[methyl(methylsulfonyl)amino]propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-N-[3-[methyl(methylsulfonyl)amino]propyl]quinoline-4-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-[3-[mesyl(methyl)amino]propyl]cinchoninamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)S(=O)(=O)C

Isomeric SMILES

CN(CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)S(=O)(=O)C

InChI

InChI=1S/C21H22FN3O3S/c1-25(29(2,27)28)13-5-12-23-21(26)18-14-20(15-8-10-16(22)11-9-15)24-19-7-4-3-6-17(18)19/h3-4,6-11,14H,5,12-13H2,1-2H3,(H,23,26)