4-[2-(4-azanyl-2-fluoranyl-phenyl)sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(4-azanyl-2-fluoranyl-phenyl)sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-(4-amino-2-fluoro-phenyl)sulfanylethoxy]benzonitrile CAS Name: 4-[2-[(4-amino-2-fluorophenyl)thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(4-amino-2-fluorophenyl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(4-amino-2-fluoro-phenyl)thio]ethoxy]benzonitrile Formula: C15H13FN2OS MolecularWeight: 288.339923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCSC2=C(C=C(C=C2)N)F

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCSC2=C(C=C(C=C2)N)F

InChI

InChI=1S/C15H13FN2OS/c16-14-9-12(18)3-6-15(14)20-8-7-19-13-4-1-11(10-17)2-5-13/h1-6,9H,7-8,18H2