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

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[(2-phenylmethoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[(2-benzyloxybenzoyl)amino]carbamothioyl]-3-(4-ethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[[oxo-(2-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[(2-phenylmethoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(2-benzoxybenzoyl)amino]thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C26H25N3O4S/c1-2-32-21-15-12-19(13-16-21)14-17-24(30)27-26(34)29-28-25(31)22-10-6-7-11-23(22)33-18-20-8-4-3-5-9-20/h3-17H,2,18H2,1H3,(H,28,31)(H2,27,29,30,34)/b17-14+