3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-N-(methylcarbamoyl)propanamide IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-N-(methylcarbamoyl)propionamide Formula: C12H14ClFN2O2S MolecularWeight: 304.768163

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CCSCC1=C(C=C(C=C1)F)Cl

Isomeric SMILES

CNC(=O)NC(=O)CCSCC1=C(C=C(C=C1)F)Cl

InChI

InChI=1S/C12H14ClFN2O2S/c1-15-12(18)16-11(17)4-5-19-7-8-2-3-9(14)6-10(8)13/h2-3,6H,4-5,7H2,1H3,(H2,15,16,17,18)