2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]piperidine-1-carbodithioic acid

Systemtic Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]piperidine-1-carbodithioic acid Openeye Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]piperidine-1-carbodithioic acid CAS Name: 2-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-1-piperidinecarbodithioic acid IUPAC Name: 2-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]piperidine-1-carbodithioic acid Traditional Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]piperidine-1-carbodithioic acid Formula: C12H18N4O2S2 MolecularWeight: 314.42692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCC2CCCCN2C(=S)S)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCC2CCCCN2C(=S)S)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O2S2/c1-9-13-8-11(16(17)18)14(9)7-5-10-4-2-3-6-15(10)12(19)20/h8,10H,2-7H2,1H3,(H,19,20)