N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-8-oxidanyl-quinoline-7-carboxamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-8-oxidanyl-quinoline-7-carboxamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-8-hydroxy-quinoline-7-carboxamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-8-hydroxy-7-quinolinecarboxamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-8-hydroxyquinoline-7-carboxamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-8-hydroxy-quinoline-7-carboxamide Formula: C19H16ClFN2O2S MolecularWeight: 390.858943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSCCNC(=O)C2=C(C3=C(C=CC=N3)C=C2)O)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSCCNC(=O)C2=C(C3=C(C=CC=N3)C=C2)O)F

InChI

InChI=1S/C19H16ClFN2O2S/c20-15-4-1-5-16(21)14(15)11-26-10-9-23-19(25)13-7-6-12-3-2-8-22-17(12)18(13)24/h1-8,24H,9-11H2,(H,23,25)