N-(2-tert-butylsulfanylethyl)-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(4-fluoro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(4-fluoro-N-mesyl-anilino)butyramide Formula: C17H27FN2O3S2 MolecularWeight: 390.536283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCSC(C)(C)C)N(C1=CC=C(C=C1)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCSC(C)(C)C)N(C1=CC=C(C=C1)F)S(=O)(=O)C

InChI

InChI=1S/C17H27FN2O3S2/c1-6-15(16(21)19-11-12-24-17(2,3)4)20(25(5,22)23)14-9-7-13(18)8-10-14/h7-10,15H,6,11-12H2,1-5H3,(H,19,21)