N-[5-(diethylsulfamoyl)-2-piperidin-1-yl-phenyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-piperidin-1-yl-phenyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(1-piperidyl)phenyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-piperidinyl)phenyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-piperidin-1-ylphenyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-piperidino-phenyl]-2-(methylthio)nicotinamide Formula: C22H30N4O3S2 MolecularWeight: 462.6286

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C22H30N4O3S2/c1-4-26(5-2)31(28,29)17-11-12-20(25-14-7-6-8-15-25)19(16-17)24-21(27)18-10-9-13-23-22(18)30-3/h9-13,16H,4-8,14-15H2,1-3H3,(H,24,27)