3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methyl-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide Formula: C25H29N5O5S2 MolecularWeight: 543.65826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N5O5S2/c1-18-7-8-20(17-23(18)37(34,35)30-15-5-3-4-6-16-30)24(31)28-21-9-11-22(12-10-21)36(32,33)29-25-26-14-13-19(2)27-25/h7-14,17H,3-6,15-16H2,1-2H3,(H,28,31)(H,26,27,29)