N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-(propan-2-ylsulfonylamino)pentanamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-(propan-2-ylsulfonylamino)pentanamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-5-(isopropylsulfonylamino)pentanamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-5-(propan-2-ylsulfonylamino)pentanamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-5-(propan-2-ylsulfonylamino)pentanamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-5-(isopropylsulfonylamino)valeramide Formula: C17H26ClFN2O3S2 MolecularWeight: 424.981343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCCCCC(=O)NCCSCC1=C(C=CC=C1Cl)F

Isomeric SMILES

CC(C)S(=O)(=O)NCCCCC(=O)NCCSCC1=C(C=CC=C1Cl)F

InChI

InChI=1S/C17H26ClFN2O3S2/c1-13(2)26(23,24)21-9-4-3-8-17(22)20-10-11-25-12-14-15(18)6-5-7-16(14)19/h5-7,13,21H,3-4,8-12H2,1-2H3,(H,20,22)