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

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[[2-(3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[[2-(3-methylphenoxy)acetyl]amino]thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-3-27-17-10-7-16(8-11-17)9-12-19(25)22-21(29)24-23-20(26)14-28-18-6-4-5-15(2)13-18/h4-13H,3,14H2,1-2H3,(H,23,26)(H2,22,24,25,29)/b12-9+