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2-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-heptyl-quinoline-4-carboxamide

2-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-heptyl-quinoline-4-carboxamide

Systemtic Name:2-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-heptyl-quinoline-4-carboxamide
Openeye Name:2-(2,4-difluorophenyl)sulfanyl-N-heptyl-quinoline-4-carboxamide
CAS Name:2-[(2,4-difluorophenyl)thio]-N-heptyl-4-quinolinecarboxamide
IUPAC Name:2-(2,4-difluorophenyl)sulfanyl-N-heptylquinoline-4-carboxamide
Traditional Name:2-[(2,4-difluorophenyl)thio]-N-heptyl-cinchoninamide
Formula: C23H24F2N2OS
MolecularWeight: 414.511266
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=C(C=C(C=C3)F)F


Isomeric SMILES

CCCCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=C(C=C(C=C3)F)F


InChI

InChI=1S/C23H24F2N2OS/c1-2-3-4-5-8-13-26-23(28)18-15-22(27-20-10-7-6-9-17(18)20)29-21-12-11-16(24)14-19(21)25/h6-7,9-12,14-15H,2-5,8,13H2,1H3,(H,26,28)


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