(E)-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(3-chloro-4-fluoro-phenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(3-chloro-4-fluorophenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(3-chloro-4-fluoro-phenyl)thiocarbamoyl]-3-(4-nitrophenyl)acrylamide Formula: C16H11ClFN3O3S MolecularWeight: 379.793243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H11ClFN3O3S/c17-13-9-11(4-7-14(13)18)19-16(25)20-15(22)8-3-10-1-5-12(6-2-10)21(23)24/h1-9H,(H2,19,20,22,25)/b8-3+