N-(2-tert-butylsulfanylethyl)-2-[(4-ethoxyphenyl)-(4-fluorophenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[(4-ethoxyphenyl)-(4-fluorophenyl)sulfonyl-amino]ethanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-(4-ethoxy-N-(4-fluorophenyl)sulfonyl-anilino)acetamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(4-ethoxy-N-(4-fluorophenyl)sulfonylanilino)acetamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(4-ethoxy-N-(4-fluorophenyl)sulfonylanilino)acetamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(4-ethoxy-N-(4-fluorophenyl)sulfonyl-anilino)acetamide Formula: C22H29FN2O4S2 MolecularWeight: 468.605063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NCCSC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NCCSC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C22H29FN2O4S2/c1-5-29-19-10-8-18(9-11-19)25(16-21(26)24-14-15-30-22(2,3)4)31(27,28)20-12-6-17(23)7-13-20/h6-13H,5,14-16H2,1-4H3,(H,24,26)