N-(4-ethoxyphenyl)sulfonyl-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)butanamide

Systemtic Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)butanamide Openeye Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)butanamide CAS Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxo-5-benzo[g][1,3]benzoxathiolyl)butanamide IUPAC Name: N-(4-ethoxyphenyl)sulfonyl-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)butanamide Traditional Name: N-(2-ketobenzo[g][1,3]benzoxathiol-5-yl)-N-p-phenetylsulfonyl-butyramide Formula: C23H21NO6S2 MolecularWeight: 471.54594

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C3=CC=CC=C31)OC(=O)S2)S(=O)(=O)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C3=CC=CC=C31)OC(=O)S2)S(=O)(=O)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C23H21NO6S2/c1-3-7-21(25)24(32(27,28)16-12-10-15(11-13-16)29-4-2)19-14-20-22(30-23(26)31-20)18-9-6-5-8-17(18)19/h5-6,8-14H,3-4,7H2,1-2H3