N-(1-adamantylthiocarbamoyl)-2-bromo-5-nitro-benzamide

Molecular Formula: C₁₈H₂₀BrN₃O₃S

InChI: InChI=1/C18H20BrN3O3S/c19-15-2-1-13(22(24)25)6-14(15)16(23)20-17(26)21-18-7-10-3-11(8-18)5-12(4-10)9-18/h1-2,6,10-12H,3-5,7-9H2,(H2,20,21,23,26)/f/h20-21H

InChIKey: InChIKey=ATUSXOCODGWCBS-BDGWVKIOCC
SMILES: C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br

Names:
    N-(1-adamantylthiocarbamoyl)-2-bromo-5-nitro-benzamide

Registries:
    PubChem CID 4475440
    PubChem ID 6596268