5-nitro-N-phenyl-2-propan-2-yl-imidazole-1-carbothioamide

Systemtic Name: 5-nitro-N-phenyl-2-propan-2-yl-imidazole-1-carbothioamide Openeye Name: 2-isopropyl-5-nitro-N-phenyl-imidazole-1-carbothioamide CAS Name: 5-nitro-N-phenyl-2-propan-2-yl-1-imidazolecarbothioamide IUPAC Name: 5-nitro-N-phenyl-2-propan-2-ylimidazole-1-carbothioamide Traditional Name: 2-isopropyl-5-nitro-N-phenyl-imidazole-1-carbothioamide Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(N1C(=S)NC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC=C(N1C(=S)NC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O2S/c1-9(2)12-14-8-11(17(18)19)16(12)13(20)15-10-6-4-3-5-7-10/h3-9H,1-2H3,(H,15,20)