N-(3-chloranyl-4-fluoranyl-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-(2-pyrimidylthio)propionamide Formula: C13H11ClFN3OS MolecularWeight: 311.762343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCC(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CN=C(N=C1)SCCC(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H11ClFN3OS/c14-10-8-9(2-3-11(10)15)18-12(19)4-7-20-13-16-5-1-6-17-13/h1-3,5-6,8H,4,7H2,(H,18,19)