N-(5-chloranyl-2-cyano-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C13H9ClN4OS MolecularWeight: 304.75476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C13H9ClN4OS/c14-10-3-2-9(7-15)11(6-10)18-12(19)8-20-13-16-4-1-5-17-13/h1-6H,8H2,(H,18,19)