3-(4-fluorophenyl)-N-[(pyridin-3-ylcarbonylamino)carbamothioyl]prop-2-enamide

Systemtic Name: 3-(4-fluorophenyl)-N-[(pyridin-3-ylcarbonylamino)carbamothioyl]prop-2-enamide Openeye Name: 3-(4-fluorophenyl)-N-[(pyridine-3-carbonylamino)carbamothioyl]prop-2-enamide CAS Name: 3-(4-fluorophenyl)-N-[[[oxo(3-pyridinyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(4-fluorophenyl)-N-[(pyridine-3-carbonylamino)carbamothioyl]prop-2-enamide Traditional Name: 3-(4-fluorophenyl)-N-(nicotinamidothiocarbamoyl)acrylamide Formula: C16H13FN4O2S MolecularWeight: 344.363423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13FN4O2S/c17-13-6-3-11(4-7-13)5-8-14(22)19-16(24)21-20-15(23)12-2-1-9-18-10-12/h1-10H,(H,20,23)(H2,19,21,22,24)