(E)-3-(3,4-dimethoxyphenyl)-N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[[2-(4-methoxyphenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[[[2-(4-methoxyphenyl)acetyl]amino]thiocarbamoyl]acrylamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NNC(=S)NC(=O)C=CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O5S/c1-27-16-8-4-15(5-9-16)13-20(26)23-24-21(30)22-19(25)11-7-14-6-10-17(28-2)18(12-14)29-3/h4-12H,13H2,1-3H3,(H,23,26)(H2,22,24,25,30)/b11-7+