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

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[(2-phenoxyethanoylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[(1-oxo-2-phenoxyethyl)hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(2-phenoxyacetyl)amino]thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H21N3O4S/c1-2-26-17-11-8-15(9-12-17)10-13-18(24)21-20(28)23-22-19(25)14-27-16-6-4-3-5-7-16/h3-13H,2,14H2,1H3,(H,22,25)(H2,21,23,24,28)/b13-10+