N-cyclopropyl-2-[[2-[ethanoyl-(2-fluorophenyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[[2-[ethanoyl-(2-fluorophenyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]quinoline-4-carboxamide Openeye Name: 2-[[2-(N-acetyl-2-fluoro-anilino)thiazol-4-yl]methylsulfanyl]-N-cyclopropyl-quinoline-4-carboxamide CAS Name: 2-[[2-(N-acetyl-2-fluoroanilino)-4-thiazolyl]methylthio]-N-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 2-[[2-(N-acetyl-2-fluoroanilino)-1,3-thiazol-4-yl]methylsulfanyl]-N-cyclopropylquinoline-4-carboxamide Traditional Name: 2-[[2-(N-acetyl-2-fluoro-anilino)thiazol-4-yl]methylthio]-N-cyclopropyl-cinchoninamide Formula: C25H21FN4O2S2 MolecularWeight: 492.588243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

InChI

InChI=1S/C25H21FN4O2S2/c1-15(31)30(22-9-5-3-7-20(22)26)25-28-17(14-34-25)13-33-23-12-19(24(32)27-16-10-11-16)18-6-2-4-8-21(18)29-23/h2-9,12,14,16H,10-11,13H2,1H3,(H,27,32)