N-[[3-(trifluoromethyl)phenyl]carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[[3-(trifluoromethyl)phenyl]carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[[3-(trifluoromethyl)phenyl]carbamothioyl]adamantane-1-carboxamide CAS Name: N-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[3-(trifluoromethyl)phenyl]carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]adamantane-1-carboxamide Formula: C19H21F3N2OS MolecularWeight: 382.44305

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3N2OS/c20-19(21,22)14-2-1-3-15(7-14)23-17(26)24-16(25)18-8-11-4-12(9-18)6-13(5-11)10-18/h1-3,7,11-13H,4-6,8-10H2,(H2,23,24,25,26)