N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-quinolin-8-ylsulfonyl-pentanamide

Systemtic Name: N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-quinolin-8-ylsulfonyl-pentanamide Openeye Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(8-quinolylsulfonyl)pentanamide CAS Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(8-quinolinylsulfonyl)pentanamide IUPAC Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-quinolin-8-ylsulfonylpentanamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-(8-quinolylsulfonyl)valeramide Formula: C21H18N2O5S2 MolecularWeight: 442.50802

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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=CC4=C3N=CC=C4

Isomeric SMILES

CCCCC(=O)N(C1=CC2=C(C=C1)OC(=O)S2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H18N2O5S2/c1-2-3-9-19(24)23(15-10-11-16-17(13-15)29-21(25)28-16)30(26,27)18-8-4-6-14-7-5-12-22-20(14)18/h4-8,10-13H,2-3,9H2,1H3