(E)-N-(furan-2-ylmethylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(furan-2-ylmethylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(2-furylmethylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(2-furanylmethylamino)-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(furan-2-ylmethylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(2-furfurylthiocarbamoyl)-3-(3-nitrophenyl)acrylamide Formula: C15H13N3O4S MolecularWeight: 331.34642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NC(=S)NCC2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NC(=S)NCC2=CC=CO2

InChI

InChI=1S/C15H13N3O4S/c19-14(17-15(23)16-10-13-5-2-8-22-13)7-6-11-3-1-4-12(9-11)18(20)21/h1-9H,10H2,(H2,16,17,19,23)/b7-6+