3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-(2-pyridylsulfamoyl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methyl-N-[4-(2-pyridinylsulfamoyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-(2-pyridylsulfamoyl)phenyl]benzamide Formula: C25H28N4O5S2 MolecularWeight: 528.64362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H28N4O5S2/c1-19-9-10-20(18-23(19)36(33,34)29-16-6-2-3-7-17-29)25(30)27-21-11-13-22(14-12-21)35(31,32)28-24-8-4-5-15-26-24/h4-5,8-15,18H,2-3,6-7,16-17H2,1H3,(H,26,28)(H,27,30)