2,4-bis(fluoranyl)-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-5-nitro-aniline

Systemtic Name: 2,4-bis(fluoranyl)-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-5-nitro-aniline Openeye Name: 2,4-difluoro-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-5-nitro-aniline CAS Name: 2,4-difluoro-N-[[5-[(methylthio)methyl]-2-furanyl]methyl]-5-nitroaniline IUPAC Name: 2,4-difluoro-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-5-nitroaniline Traditional Name: (2,4-difluoro-5-nitro-phenyl)-[[5-[(methylthio)methyl]-2-furyl]methyl]amine Formula: C13H12F2N2O3S MolecularWeight: 314.307786

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)CNC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

CSCC1=CC=C(O1)CNC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12F2N2O3S/c1-21-7-9-3-2-8(20-9)6-16-12-5-13(17(18)19)11(15)4-10(12)14/h2-5,16H,6-7H2,1H3