(E)-N-[(2-bromanyl-4-nitro-phenyl)carbamothioyl]-3-(2-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-bromanyl-4-nitro-phenyl)carbamothioyl]-3-(2-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-[(2-bromo-4-nitro-phenyl)carbamothioyl]-3-(2-chlorophenyl)prop-2-enamide CAS Name: (E)-N-[(2-bromo-4-nitroanilino)-sulfanylidenemethyl]-3-(2-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-[(2-bromo-4-nitrophenyl)carbamothioyl]-3-(2-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-[(2-bromo-4-nitro-phenyl)thiocarbamoyl]-3-(2-chlorophenyl)acrylamide Formula: C16H11BrClN3O3S MolecularWeight: 440.69884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrClN3O3S/c17-12-9-11(21(23)24)6-7-14(12)19-16(25)20-15(22)8-5-10-3-1-2-4-13(10)18/h1-9H,(H2,19,20,22,25)/b8-5+