1-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]-N-(5-chloranylpyridin-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]-N-(5-chloranylpyridin-2-yl)piperidine-3-carboxamide Openeye Name: 1-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]-N-(5-chloro-2-pyridyl)piperidine-3-carboxamide CAS Name: 1-[4-(tert-butylsulfamoyl)-2-nitrophenyl]-N-(5-chloro-2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: 1-[4-(tert-butylsulfamoyl)-2-nitrophenyl]-N-(5-chloropyridin-2-yl)piperidine-3-carboxamide Traditional Name: 1-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]-N-(5-chloro-2-pyridyl)nipecotamide Formula: C21H26ClN5O5S MolecularWeight: 495.97964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCCC(C2)C(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCCC(C2)C(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H26ClN5O5S/c1-21(2,3)25-33(31,32)16-7-8-17(18(11-16)27(29)30)26-10-4-5-14(13-26)20(28)24-19-9-6-15(22)12-23-19/h6-9,11-12,14,25H,4-5,10,13H2,1-3H3,(H,23,24,28)