3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-N-[(2,5-dimethoxyphenyl)methyl]propanamide

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-N-[(2,5-dimethoxyphenyl)methyl]propanamide Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-N-[(2,5-dimethoxyphenyl)methyl]propanamide CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-N-[(2,5-dimethoxyphenyl)methyl]propanamide IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-N-[(2,5-dimethoxyphenyl)methyl]propanamide Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-N-(2,5-dimethoxybenzyl)propionamide Formula: C19H21ClFNO3S MolecularWeight: 397.891343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)CCSCC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)CCSCC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C19H21ClFNO3S/c1-24-16-5-6-18(25-2)14(9-16)11-22-19(23)7-8-26-12-13-3-4-15(21)10-17(13)20/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,22,23)