2-chloranyl-5-(dimethylsulfamoyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 2-chloranyl-5-(dimethylsulfamoyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide Openeye Name: 2-chloro-5-(dimethylsulfamoyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide CAS Name: 2-chloro-5-(dimethylsulfamoyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]benzamide IUPAC Name: 2-chloro-5-(dimethylsulfamoyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]benzamide Traditional Name: 2-chloro-5-(dimethylsulfamoyl)-N-[6-(3-ketopiperazino)-3-pyridyl]benzamide Formula: C18H20ClN5O4S MolecularWeight: 437.9005

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C18H20ClN5O4S/c1-23(2)29(27,28)13-4-5-15(19)14(9-13)18(26)22-12-3-6-16(21-10-12)24-8-7-20-17(25)11-24/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,25)(H,22,26)