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

Systemtic Name: N-(2,2-dimethylpropyl)-2-[2-(phenylsulfonyl)ethylsulfanyl]pyridine-3-carboxamide Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-(2,2-dimethylpropyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide Traditional Name: 2-(2-besylethylthio)-N-neopentyl-nicotinamide Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3S2/c1-19(2,3)14-21-17(22)16-10-7-11-20-18(16)25-12-13-26(23,24)15-8-5-4-6-9-15/h4-11H,12-14H2,1-3H3,(H,21,22)