2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]quinoline-4-carboxamide Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]quinoline-4-carboxamide CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-4-quinolinecarboxamide IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]quinoline-4-carboxamide Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]cinchoninamide Formula: C18H15FN2O2S MolecularWeight: 342.387303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=C2)C(=O)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=C2)C(=O)N)F

InChI

InChI=1S/C18H15FN2O2S/c1-23-16-7-6-11(8-14(16)19)10-24-17-9-13(18(20)22)12-4-2-3-5-15(12)21-17/h2-9H,10H2,1H3,(H2,20,22)