N-(4-ethoxyphenyl)sulfonyl-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)pentanamide

Systemtic Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)pentanamide Openeye Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pentanamide CAS Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pentanamide IUPAC Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pentanamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-p-phenetylsulfonyl-valeramide Formula: C20H21NO6S2 MolecularWeight: 435.51384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(C1=CC2=C(C=C1)OC(=O)S2)S(=O)(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCC(=O)N(C1=CC2=C(C=C1)OC(=O)S2)S(=O)(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C20H21NO6S2/c1-3-5-6-19(22)21(14-7-12-17-18(13-14)28-20(23)27-17)29(24,25)16-10-8-15(9-11-16)26-4-2/h7-13H,3-6H2,1-2H3