2-fluoranyl-4-nitro-6-(phenylmethylsulfanyl)benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-nitro-6-(phenylmethylsulfanyl)benzenecarbonitrile Openeye Name: 2-benzylsulfanyl-6-fluoro-4-nitro-benzonitrile CAS Name: 2-fluoro-4-nitro-6-(phenylmethylthio)benzonitrile IUPAC Name: 2-benzylsulfanyl-6-fluoro-4-nitrobenzonitrile Traditional Name: 2-(benzylthio)-6-fluoro-4-nitro-benzonitrile Formula: C14H9FN2O2S MolecularWeight: 288.296863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC(=CC(=C2C#N)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC(=CC(=C2C#N)F)[N+](=O)[O-]

InChI

InChI=1S/C14H9FN2O2S/c15-13-6-11(17(18)19)7-14(12(13)8-16)20-9-10-4-2-1-3-5-10/h1-7H,9H2