1,3-bis(2-ethylsulfanylethyl)-4-nitro-imidazol-1-ium

Systemtic Name: 1,3-bis(2-ethylsulfanylethyl)-4-nitro-imidazol-1-ium Openeye Name: 1,3-bis(2-ethylsulfanylethyl)-4-nitro-imidazol-1-ium CAS Name: 1,3-bis[2-(ethylthio)ethyl]-4-nitroimidazol-1-ium IUPAC Name: 1,3-bis(2-ethylsulfanylethyl)-4-nitroimidazol-1-ium Traditional Name: 1,3-bis[2-(ethylthio)ethyl]-4-nitro-imidazol-1-ium Formula: C11H20N3O2S2+ MolecularWeight: 290.4254

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN1C=[N+](C=C1[N+](=O)[O-])CCSCC

Isomeric SMILES

CCSCCN1C=[N+](C=C1[N+](=O)[O-])CCSCC

InChI

InChI=1S/C11H20N3O2S2/c1-3-17-7-5-12-9-11(14(15)16)13(10-12)6-8-18-4-2/h9-10H,3-8H2,1-2H3/q+1