N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-(2,4,6-trimethylphenyl)sulfonyl-butanamide

Systemtic Name: N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-(2,4,6-trimethylphenyl)sulfonyl-butanamide Openeye Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(2,4,6-trimethylphenyl)sulfonyl-butanamide CAS Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(2,4,6-trimethylphenyl)sulfonylbutanamide IUPAC Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(2,4,6-trimethylphenyl)sulfonylbutanamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-mesitylsulfonyl-butyramide Formula: C20H21NO5S2 MolecularWeight: 419.51444

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C=C1)OC(=O)S2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)OC(=O)S2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C20H21NO5S2/c1-5-6-18(22)21(15-7-8-16-17(11-15)27-20(23)26-16)28(24,25)19-13(3)9-12(2)10-14(19)4/h7-11H,5-6H2,1-4H3