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

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[(4-benzyloxybenzoyl)amino]carbamothioyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[[oxo-(4-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[(4-phenylmethoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(4-benzoxybenzoyl)amino]thiocarbamoyl]-3-(3,4-dimethoxyphenyl)acrylamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C26H25N3O5S/c1-32-22-14-8-18(16-23(22)33-2)9-15-24(30)27-26(35)29-28-25(31)20-10-12-21(13-11-20)34-17-19-6-4-3-5-7-19/h3-16H,17H2,1-2H3,(H,28,31)(H2,27,29,30,35)/b15-9+