4-methyl-N-[(2-pentan-2-ylphenyl)carbamothioyl]-3-(trifluoromethyl)benzamide

Systemtic Name: 4-methyl-N-[(2-pentan-2-ylphenyl)carbamothioyl]-3-(trifluoromethyl)benzamide Openeye Name: 4-methyl-N-[[2-(1-methylbutyl)phenyl]carbamothioyl]-3-(trifluoromethyl)benzamide CAS Name: 4-methyl-N-[(2-pentan-2-ylanilino)-sulfanylidenemethyl]-3-(trifluoromethyl)benzamide IUPAC Name: 4-methyl-N-[(2-pentan-2-ylphenyl)carbamothioyl]-3-(trifluoromethyl)benzamide Traditional Name: 4-methyl-N-[[2-(1-methylbutyl)phenyl]thiocarbamoyl]-3-(trifluoromethyl)benzamide Formula: C21H23F3N2OS MolecularWeight: 408.48033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)C)C(F)(F)F

Isomeric SMILES

CCCC(C)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)C)C(F)(F)F

InChI

InChI=1S/C21H23F3N2OS/c1-4-7-13(2)16-8-5-6-9-18(16)25-20(28)26-19(27)15-11-10-14(3)17(12-15)21(22,23)24/h5-6,8-13H,4,7H2,1-3H3,(H2,25,26,27,28)