2-(4-fluorophenyl)sulfanyl-N-[2-methyl-3-(4-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfanyl-N-[2-methyl-3-(4-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfanyl-N-[2-methyl-3-(4-methyl-1-piperidyl)propyl]quinoline-4-carboxamide CAS Name: 2-[(4-fluorophenyl)thio]-N-[2-methyl-3-(4-methyl-1-piperidinyl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-fluorophenyl)sulfanyl-N-[2-methyl-3-(4-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-[2-methyl-3-(4-methylpiperidino)propyl]cinchoninamide Formula: C26H30FN3OS MolecularWeight: 451.599303

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(C)CNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)F

Isomeric SMILES

CC1CCN(CC1)CC(C)CNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)F

InChI

InChI=1S/C26H30FN3OS/c1-18-11-13-30(14-12-18)17-19(2)16-28-26(31)23-15-25(29-24-6-4-3-5-22(23)24)32-21-9-7-20(27)8-10-21/h3-10,15,18-19H,11-14,16-17H2,1-2H3,(H,28,31)