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

Systemtic Name: (E)-N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-N-[[[(4-acetamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-N-[[(4-acetamidobenzoyl)amino]thiocarbamoyl]-3-(4-fluorophenyl)acrylamide Formula: C19H17FN4O3S MolecularWeight: 400.426683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C=CC2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=C(C=C2)F

InChI

InChI=1S/C19H17FN4O3S/c1-12(25)21-16-9-5-14(6-10-16)18(27)23-24-19(28)22-17(26)11-4-13-2-7-15(20)8-3-13/h2-11H,1H3,(H,21,25)(H,23,27)(H2,22,24,26,28)/b11-4+