2-(1-adamantyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]acetamide Formula: C20H23F3N2OS MolecularWeight: 396.46963

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H23F3N2OS/c21-20(22,23)15-2-1-3-16(7-15)24-18(27)25-17(26)11-19-8-12-4-13(9-19)6-14(5-12)10-19/h1-3,7,12-14H,4-6,8-11H2,(H2,24,25,26,27)