2-[(3-ethanoylphenyl)-methylsulfonyl-amino]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-[(3-ethanoylphenyl)-methylsulfonyl-amino]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(3-acetyl-N-methylsulfonyl-anilino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide CAS Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-[2-[(2-fluorophenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(3-acetyl-N-mesyl-anilino)-N-[2-[(2-fluorobenzyl)thio]ethyl]acetamide Formula: C20H23FN2O4S2 MolecularWeight: 438.536023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(CC(=O)NCCSCC2=CC=CC=C2F)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(CC(=O)NCCSCC2=CC=CC=C2F)S(=O)(=O)C

InChI

InChI=1S/C20H23FN2O4S2/c1-15(24)16-7-5-8-18(12-16)23(29(2,26)27)13-20(25)22-10-11-28-14-17-6-3-4-9-19(17)21/h3-9,12H,10-11,13-14H2,1-2H3,(H,22,25)