4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]benzamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(2-pyrimidylsulfamoyl)phenyl]benzamide Formula: C26H23N5O7S2 MolecularWeight: 581.62012

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5)OC1

InChI

InChI=1S/C26H23N5O7S2/c32-25(29-19-7-9-21(10-8-19)39(33,34)31-26-27-13-1-14-28-26)18-3-5-20(6-4-18)30-40(35,36)22-11-12-23-24(17-22)38-16-2-15-37-23/h1,3-14,17,30H,2,15-16H2,(H,29,32)(H,27,28,31)