N-(3-chloranyl-4-methylsulfanyl-phenyl)-3,3,3-tris(fluoranyl)-2-oxidanyl-2-(phenylmethyl)propanamide

Systemtic Name: N-(3-chloranyl-4-methylsulfanyl-phenyl)-3,3,3-tris(fluoranyl)-2-oxidanyl-2-(phenylmethyl)propanamide Openeye Name: 2-benzyl-N-(3-chloro-4-methylsulfanyl-phenyl)-3,3,3-trifluoro-2-hydroxy-propanamide CAS Name: N-[3-chloro-4-(methylthio)phenyl]-3,3,3-trifluoro-2-hydroxy-2-(phenylmethyl)propanamide IUPAC Name: 2-benzyl-N-(3-chloro-4-methylsulfanylphenyl)-3,3,3-trifluoro-2-hydroxypropanamide Traditional Name: 2-benzyl-N-[3-chloro-4-(methylthio)phenyl]-3,3,3-trifluoro-2-hydroxy-propionamide Formula: C17H15ClF3NO2S MolecularWeight: 389.81971

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)NC(=O)C(CC2=CC=CC=C2)(C(F)(F)F)O)Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)NC(=O)C(CC2=CC=CC=C2)(C(F)(F)F)O)Cl

InChI

InChI=1S/C17H15ClF3NO2S/c1-25-14-8-7-12(9-13(14)18)22-15(23)16(24,17(19,20)21)10-11-5-3-2-4-6-11/h2-9,24H,10H2,1H3,(H,22,23)