N-(2-fluorophenyl)-5-nitro-2-propan-2-yl-imidazole-1-carbothioamide

Systemtic Name: N-(2-fluorophenyl)-5-nitro-2-propan-2-yl-imidazole-1-carbothioamide Openeye Name: N-(2-fluorophenyl)-2-isopropyl-5-nitro-imidazole-1-carbothioamide CAS Name: N-(2-fluorophenyl)-5-nitro-2-propan-2-yl-1-imidazolecarbothioamide IUPAC Name: N-(2-fluorophenyl)-5-nitro-2-propan-2-ylimidazole-1-carbothioamide Traditional Name: N-(2-fluorophenyl)-2-isopropyl-5-nitro-imidazole-1-carbothioamide Formula: C13H13FN4O2S MolecularWeight: 308.331323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(N1C(=S)NC2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC=C(N1C(=S)NC2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C13H13FN4O2S/c1-8(2)12-15-7-11(18(19)20)17(12)13(21)16-10-6-4-3-5-9(10)14/h3-8H,1-2H3,(H,16,21)