2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C20H25FN2O3S2 MolecularWeight: 424.552503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CN(C1=CC(=CC=C1)F)S(=O)(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCC(C)(C)NC(=O)CN(C1=CC(=CC=C1)F)S(=O)(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C20H25FN2O3S2/c1-5-20(2,3)22-19(24)14-23(16-8-6-7-15(21)13-16)28(25,26)18-11-9-17(27-4)10-12-18/h6-13H,5,14H2,1-4H3,(H,22,24)