O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] N-(furan-2-ylcarbonyl)carbamothioate

Systemtic Name: O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] N-(furan-2-ylcarbonyl)carbamothioate Openeye Name: O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] N-(furan-2-carbonyl)carbamothioate CAS Name: N-[2-furanyl(oxo)methyl]carbamothioic acid O-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl] ester IUPAC Name: O-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl] N-(furan-2-carbonyl)carbamothioate Traditional Name: N-(2-furoyl)thiocarbamic acid O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] ester Formula: C12H12N4O5S MolecularWeight: 324.31248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=S)NC(=O)C2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=S)NC(=O)C2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O5S/c1-8-13-7-10(16(18)19)15(8)4-6-21-12(22)14-11(17)9-3-2-5-20-9/h2-3,5,7H,4,6H2,1H3,(H,14,17,22)