(E)-3-(4-fluorophenyl)-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-fluorophenyl)-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[(4-benzyloxybenzoyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-3-(4-fluorophenyl)-N-[[[oxo-(4-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-fluorophenyl)-N-[[(4-phenylmethoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(4-benzoxybenzoyl)amino]thiocarbamoyl]-3-(4-fluorophenyl)acrylamide Formula: C24H20FN3O3S MolecularWeight: 449.497303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C24H20FN3O3S/c25-20-11-6-17(7-12-20)8-15-22(29)26-24(32)28-27-23(30)19-9-13-21(14-10-19)31-16-18-4-2-1-3-5-18/h1-15H,16H2,(H,27,30)(H2,26,28,29,32)/b15-8+