N-(2,5-diethylphenyl)sulfonyl-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)pentanamide

Systemtic Name: N-(2,5-diethylphenyl)sulfonyl-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)pentanamide Openeye Name: N-(2,5-diethylphenyl)sulfonyl-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)pentanamide CAS Name: N-(2,5-diethylphenyl)sulfonyl-N-(2-oxo-5-benzo[g][1,3]benzoxathiolyl)pentanamide IUPAC Name: N-(2,5-diethylphenyl)sulfonyl-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)pentanamide Traditional Name: N-(2,5-diethylphenyl)sulfonyl-N-(2-ketobenzo[g][1,3]benzoxathiol-5-yl)valeramide Formula: C26H27NO5S2 MolecularWeight: 497.62628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO5S2/c1-4-7-12-24(28)27(34(30,31)23-15-17(5-2)13-14-18(23)6-3)21-16-22-25(32-26(29)33-22)20-11-9-8-10-19(20)21/h8-11,13-16H,4-7,12H2,1-3H3