(E)-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide

Systemtic Name: (E)-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide Openeye Name: (E)-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-3-(1-naphthyl)prop-2-enamide CAS Name: (E)-N-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(1-naphthalenyl)-2-propenamide IUPAC Name: (E)-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide Traditional Name: (E)-N-[[[2-(4-bromophenoxy)acetyl]amino]thiocarbamoyl]-3-(1-naphthyl)acrylamide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C=CC(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2/C=C/C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrN3O3S/c23-17-9-11-18(12-10-17)29-14-21(28)25-26-22(30)24-20(27)13-8-16-6-3-5-15-4-1-2-7-19(15)16/h1-13H,14H2,(H,25,28)(H2,24,26,27,30)/b13-8+