N-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-(1,1-dioxothiolan-3-yl)-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-(1,1-dioxo-3-thiolanyl)-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-(1,1-dioxothiolan-3-yl)-3-methyl-5-nitroimidazol-4-amine Traditional Name: (1,1-diketothiolan-3-yl)-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C8H12N4O4S MolecularWeight: 260.27028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NC2CCS(=O)(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NC2CCS(=O)(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O4S/c1-11-5-9-7(12(13)14)8(11)10-6-2-3-17(15,16)4-6/h5-6,10H,2-4H2,1H3