3-[(5-nitrofuran-2-yl)methyl]-1H-imidazole-2-thione

Systemtic Name: 3-[(5-nitrofuran-2-yl)methyl]-1H-imidazole-2-thione Openeye Name: 3-[(5-nitro-2-furyl)methyl]-1H-imidazole-2-thione CAS Name: 3-[(5-nitro-2-furanyl)methyl]-1H-imidazole-2-thione IUPAC Name: 3-[(5-nitrofuran-2-yl)methyl]-1H-imidazole-2-thione Traditional Name: 1-[(5-nitro-2-furyl)methyl]-4-imidazoline-2-thione Formula: C8H7N3O3S MolecularWeight: 225.22448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=S)N1)CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C(=S)N1)CC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C8H7N3O3S/c12-11(13)7-2-1-6(14-7)5-10-4-3-9-8(10)15/h1-4H,5H2,(H,9,15)