(E)-N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-3-(furan-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-3-(furan-2-yl)prop-2-enamide Openeye Name: (E)-N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamothioyl]-3-(2-furyl)prop-2-enamide CAS Name: (E)-N-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(2-furanyl)-2-propenamide IUPAC Name: (E)-N-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamothioyl]-3-(furan-2-yl)prop-2-enamide Traditional Name: (E)-N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]thiocarbamoyl]-3-(2-furyl)acrylamide Formula: C18H18BrN3O4S MolecularWeight: 452.32222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C=CC2=CC=CO2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)/C=C/C2=CC=CO2)Br

InChI

InChI=1S/C18H18BrN3O4S/c1-2-12-5-7-15(14(19)10-12)26-11-17(24)21-22-18(27)20-16(23)8-6-13-4-3-9-25-13/h3-10H,2,11H2,1H3,(H,21,24)(H2,20,22,23,27)/b8-6+