N-[(2S)-4-methylsulfonyl-1-[4-(oxidanylcarbamoyl)phenoxy]butan-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2S)-4-methylsulfonyl-1-[4-(oxidanylcarbamoyl)phenoxy]butan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[(1S)-1-[[4-(hydroxycarbamoyl)phenoxy]methyl]-3-methylsulfonyl-propyl]benzofuran-2-carboxamide CAS Name: N-[(2S)-1-[4-[(hydroxyamino)-oxomethyl]phenoxy]-4-methylsulfonylbutan-2-yl]-2-benzofurancarboxamide IUPAC Name: N-[(2S)-1-[4-(hydroxycarbamoyl)phenoxy]-4-methylsulfonylbutan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[(1S)-1-[[4-(hydroxycarbamoyl)phenoxy]methyl]-3-mesyl-propyl]coumarilamide Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(COC1=CC=C(C=C1)C(=O)NO)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CS(=O)(=O)CC[C@@H](COC1=CC=C(C=C1)C(=O)NO)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C21H22N2O7S/c1-31(27,28)11-10-16(13-29-17-8-6-14(7-9-17)20(24)23-26)22-21(25)19-12-15-4-2-3-5-18(15)30-19/h2-9,12,16,26H,10-11,13H2,1H3,(H,22,25)(H,23,24)/t16-/m0/s1