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

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-[[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[3-[oxo-[3-(trifluoromethyl)anilino]methyl]anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-[[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-[[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C30H23BrF3N3O3S MolecularWeight: 642.48613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F)Br

InChI

InChI=1S/C30H23BrF3N3O3S/c31-25-17-21(12-13-26(25)40-15-14-19-6-2-1-3-7-19)28(39)37-29(41)36-23-10-4-8-20(16-23)27(38)35-24-11-5-9-22(18-24)30(32,33)34/h1-13,16-18H,14-15H2,(H,35,38)(H2,36,37,39,41)