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

Systemtic Name: (E)-3-naphthalen-1-yl-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(1-naphthyl)-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(1-naphthalenyl)-N-[[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-naphthalen-1-yl-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(1-naphthyl)-N-[[[2-(4-nitrophenoxy)acetyl]amino]thiocarbamoyl]acrylamide Formula: C22H18N4O5S MolecularWeight: 450.46712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C=CC(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2/C=C/C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O5S/c27-20(13-8-16-6-3-5-15-4-1-2-7-19(15)16)23-22(32)25-24-21(28)14-31-18-11-9-17(10-12-18)26(29)30/h1-13H,14H2,(H,24,28)(H2,23,25,27,32)/b13-8+