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

Systemtic Name: N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-quinolin-8-ylsulfonyl-pyridine-3-carboxamide Openeye Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(8-quinolylsulfonyl)pyridine-3-carboxamide CAS Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(8-quinolinylsulfonyl)-3-pyridinecarboxamide IUPAC Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-quinolin-8-ylsulfonylpyridine-3-carboxamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-(8-quinolylsulfonyl)nicotinamide Formula: C22H13N3O5S2 MolecularWeight: 463.48572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)N(C3=CC4=C(C=C3)OC(=O)S4)C(=O)C5=CN=CC=C5)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)N(C3=CC4=C(C=C3)OC(=O)S4)C(=O)C5=CN=CC=C5)N=CC=C2

InChI

InChI=1S/C22H13N3O5S2/c26-21(15-6-2-10-23-13-15)25(16-8-9-17-18(12-16)31-22(27)30-17)32(28,29)19-7-1-4-14-5-3-11-24-20(14)19/h1-13H