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

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[[[2-(2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-[[[2-(2-methylphenoxy)acetyl]amino]thiocarbamoyl]acrylamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H21N3O4S/c1-14-5-3-4-6-17(14)27-13-19(25)22-23-20(28)21-18(24)12-9-15-7-10-16(26-2)11-8-15/h3-12H,13H2,1-2H3,(H,22,25)(H2,21,23,24,28)/b12-9+