2-fluoranyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-aniline

Systemtic Name: 2-fluoranyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-aniline Openeye Name: 2-fluoro-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-aniline CAS Name: 2-fluoro-N-[[4-(methylthio)phenyl]methyl]-5-nitroaniline IUPAC Name: 2-fluoro-N-[(4-methylsulfanylphenyl)methyl]-5-nitroaniline Traditional Name: (2-fluoro-5-nitro-phenyl)-[4-(methylthio)benzyl]amine Formula: C14H13FN2O2S MolecularWeight: 292.328623

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CSC1=CC=C(C=C1)CNC2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C14H13FN2O2S/c1-20-12-5-2-10(3-6-12)9-16-14-8-11(17(18)19)4-7-13(14)15/h2-8,16H,9H2,1H3