(E)-3-(4-methylphenyl)-N-[[2-(4-phenylphenoxy)ethanoylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methylphenyl)-N-[[2-(4-phenylphenoxy)ethanoylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-3-(4-methylphenyl)-N-[[[1-oxo-2-(4-phenylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-methylphenyl)-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[[2-(4-phenylphenoxy)acetyl]amino]thiocarbamoyl]-3-(p-tolyl)acrylamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H23N3O3S/c1-18-7-9-19(10-8-18)11-16-23(29)26-25(32)28-27-24(30)17-31-22-14-12-21(13-15-22)20-5-3-2-4-6-20/h2-16H,17H2,1H3,(H,27,30)(H2,26,28,29,32)/b16-11+