N-[4-(azepan-1-yl)phenyl]-2-[5-(dimethylsulfamoyl)-2-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[5-(dimethylsulfamoyl)-2-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridyl]acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[5-(dimethylsulfamoyl)-2-oxopyridin-1-yl]acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[5-(dimethylsulfamoyl)-2-keto-1-pyridyl]acetamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)CC(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)CC(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C21H28N4O4S/c1-23(2)30(28,29)19-11-12-21(27)25(15-19)16-20(26)22-17-7-9-18(10-8-17)24-13-5-3-4-6-14-24/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,22,26)