3-(azepan-1-ylsulfonyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[5-(diethylsulfamoyl)-2-(4-morpholinyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]benzamide Formula: C27H38N4O6S2 MolecularWeight: 578.74382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H38N4O6S2/c1-3-30(4-2)38(33,34)24-12-13-26(29-16-18-37-19-17-29)25(21-24)28-27(32)22-10-9-11-23(20-22)39(35,36)31-14-7-5-6-8-15-31/h9-13,20-21H,3-8,14-19H2,1-2H3,(H,28,32)