2-[1-(4-methylsulfanylphenyl)-2-nitro-ethyl]sulfanylaniline

Systemtic Name: 2-[1-(4-methylsulfanylphenyl)-2-nitro-ethyl]sulfanylaniline Openeye Name: 2-[1-(4-methylsulfanylphenyl)-2-nitro-ethyl]sulfanylaniline CAS Name: 2-[[1-[4-(methylthio)phenyl]-2-nitroethyl]thio]aniline IUPAC Name: 2-[1-(4-methylsulfanylphenyl)-2-nitroethyl]sulfanylaniline Traditional Name: [2-[[1-[4-(methylthio)phenyl]-2-nitro-ethyl]thio]phenyl]amine Formula: C15H16N2O2S2 MolecularWeight: 320.42974

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C[N+](=O)[O-])SC2=CC=CC=C2N

Isomeric SMILES

CSC1=CC=C(C=C1)C(C[N+](=O)[O-])SC2=CC=CC=C2N

InChI

InChI=1S/C15H16N2O2S2/c1-20-12-8-6-11(7-9-12)15(10-17(18)19)21-14-5-3-2-4-13(14)16/h2-9,15H,10,16H2,1H3