(E)-N-[(2-cyanophenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-cyanophenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-N-[(2-cyanophenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-N-[(2-cyanoanilino)-sulfanylidenemethyl]-3-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-N-[(2-cyanophenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-N-[(2-cyanophenyl)thiocarbamoyl]-3-(4-fluorophenyl)acrylamide Formula: C17H12FN3OS MolecularWeight: 325.360083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)C=CC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)F

InChI

InChI=1S/C17H12FN3OS/c18-14-8-5-12(6-9-14)7-10-16(22)21-17(23)20-15-4-2-1-3-13(15)11-19/h1-10H,(H2,20,21,22,23)/b10-7+