N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[(E)-(2-chloro-6-fluoro-phenyl)methyleneamino]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[(E)-(2-chloro-6-fluoro-benzylidene)amino]-2-(2-pyrimidylthio)acetamide Formula: C13H10ClFN4OS MolecularWeight: 324.761103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C=NNC(=O)CSC2=NC=CC=N2)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)/C=N/NC(=O)CSC2=NC=CC=N2)F

InChI

InChI=1S/C13H10ClFN4OS/c14-10-3-1-4-11(15)9(10)7-18-19-12(20)8-21-13-16-5-2-6-17-13/h1-7H,8H2,(H,19,20)/b18-7+