5-(azepan-1-ylsulfonyl)-2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-[4-(2-pyrimidinylsulfamoyl)phenyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[4-(2-pyrimidylsulfamoyl)phenyl]benzamide Formula: C24H27N5O6S2 MolecularWeight: 545.63108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C24H27N5O6S2/c1-35-22-12-11-20(37(33,34)29-15-4-2-3-5-16-29)17-21(22)23(30)27-18-7-9-19(10-8-18)36(31,32)28-24-25-13-6-14-26-24/h6-14,17H,2-5,15-16H2,1H3,(H,27,30)(H,25,26,28)