methyl 5-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(2-methyl-5-nitro-1H-imidazol-4-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(2-methyl-5-nitro-1H-imidazol-4-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C11H11N3O5S MolecularWeight: 297.28714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1)[N+](=O)[O-])SCC2=CC=C(O2)C(=O)OC

Isomeric SMILES

CC1=NC(=C(N1)[N+](=O)[O-])SCC2=CC=C(O2)C(=O)OC

InChI

InChI=1S/C11H11N3O5S/c1-6-12-9(14(16)17)10(13-6)20-5-7-3-4-8(19-7)11(15)18-2/h3-4H,5H2,1-2H3,(H,12,13)