5-[2,4-bis(fluoranyl)phenyl]sulfanyl-2-methyl-4-nitro-benzenecarbonitrile

Systemtic Name: 5-[2,4-bis(fluoranyl)phenyl]sulfanyl-2-methyl-4-nitro-benzenecarbonitrile Openeye Name: 5-(2,4-difluorophenyl)sulfanyl-2-methyl-4-nitro-benzonitrile CAS Name: 5-[(2,4-difluorophenyl)thio]-2-methyl-4-nitrobenzonitrile IUPAC Name: 5-(2,4-difluorophenyl)sulfanyl-2-methyl-4-nitrobenzonitrile Traditional Name: 5-[(2,4-difluorophenyl)thio]-2-methyl-4-nitro-benzonitrile Formula: C14H8F2N2O2S MolecularWeight: 306.287326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#N)SC2=C(C=C(C=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1C#N)SC2=C(C=C(C=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H8F2N2O2S/c1-8-4-12(18(19)20)14(5-9(8)7-17)21-13-3-2-10(15)6-11(13)16/h2-6H,1H3