N-(2-ethylbutyl)-2-[2-(phenylsulfonyl)ethylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(2-ethylbutyl)-2-[2-(phenylsulfonyl)ethylsulfanyl]pyridine-3-carboxamide Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-(2-ethylbutyl)pyridine-3-carboxamide CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-(2-ethylbutyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-(2-ethylbutyl)pyridine-3-carboxamide Traditional Name: 2-(2-besylethylthio)-N-(2-ethylbutyl)nicotinamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)C1=C(N=CC=C1)SCCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(CC)CNC(=O)C1=C(N=CC=C1)SCCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H26N2O3S2/c1-3-16(4-2)15-22-19(23)18-11-8-12-21-20(18)26-13-14-27(24,25)17-9-6-5-7-10-17/h5-12,16H,3-4,13-15H2,1-2H3,(H,22,23)