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

Systemtic Name: N-(3,4-dimethoxyphenyl)sulfonyl-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)pentanamide Openeye Name: N-(3,4-dimethoxyphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pentanamide CAS Name: N-(3,4-dimethoxyphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pentanamide IUPAC Name: N-(3,4-dimethoxyphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)pentanamide Traditional Name: N-(3,4-dimethoxyphenyl)sulfonyl-N-(2-keto-1,3-benzoxathiol-5-yl)valeramide Formula: C20H21NO7S2 MolecularWeight: 451.51324

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO7S2/c1-4-5-6-19(22)21(13-7-9-16-18(11-13)29-20(23)28-16)30(24,25)14-8-10-15(26-2)17(12-14)27-3/h7-12H,4-6H2,1-3H3