(E)-3-(4-methoxyphenyl)-N-[(2-phenoxyethanoylamino)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[(2-phenoxyethanoylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[[(1-oxo-2-phenoxyethyl)hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-[[(2-phenoxyacetyl)amino]thiocarbamoyl]acrylamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)COC2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C19H19N3O4S/c1-25-15-10-7-14(8-11-15)9-12-17(23)20-19(27)22-21-18(24)13-26-16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,21,24)(H2,20,22,23,27)/b12-9+