Molecule ID: 5094

IUPAC Name: (1-methyl-5-nitroimidazol-2-yl)methyl carbamate

Description: The molecule is a carbamate ester that is 5-nitroimidazole in which the hydrogens at positions 1 and 2 are replaced by methyl and (carbamoyloxy)methyl groups, respectively. An antiprotozoal agent, it is used in veterinary medicine for the treatment of histomoniasis and swine dysentery. It has a role as an antiprotozoal drug and an antiparasitic agent. It is a member of imidazoles, a carbamate ester and a C-nitro compound.

SMILES: Cn1c([N+](=O)[O-])cnc1COC(=N)O

SELFIES: [C][N][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][N][=C][Ring1][Branch2][C][O][C][=Branch1][C][=N][O]

InChI: InChI=1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)

Molecular Properties:
- Polar Surface Area: 116.0 Ų
- LogP: -0.4