3-bromanyl-4-propoxy-N-[[4-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-propoxy-N-[[4-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-propoxy-N-[[4-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[4-[oxo-[3-(trifluoromethyl)anilino]methyl]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-4-propoxy-N-[[4-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-propoxy-N-[[4-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C25H21BrF3N3O3S MolecularWeight: 580.41675

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)Br

InChI

InChI=1S/C25H21BrF3N3O3S/c1-2-12-35-21-11-8-16(13-20(21)26)23(34)32-24(36)31-18-9-6-15(7-10-18)22(33)30-19-5-3-4-17(14-19)25(27,28)29/h3-11,13-14H,2,12H2,1H3,(H,30,33)(H2,31,32,34,36)