(E)-N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(4-bromo-2,6-dimethyl-phenyl)carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C22H19BrN2O2S MolecularWeight: 455.36746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=S)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3)C)Br

InChI

InChI=1S/C22H19BrN2O2S/c1-14-12-17(23)13-15(2)21(14)25-22(28)24-20(26)11-9-18-8-10-19(27-18)16-6-4-3-5-7-16/h3-13H,1-2H3,(H2,24,25,26,28)/b11-9+