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

Systemtic Name: 2-[2-(phenylsulfonyl)ethylsulfanyl]-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-(2-pyridylmethyl)pyridine-3-carboxamide CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-(2-pyridinylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-(2-besylethylthio)-N-(2-pyridylmethyl)nicotinamide Formula: C20H19N3O3S2 MolecularWeight: 413.51316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C20H19N3O3S2/c24-19(23-15-16-7-4-5-11-21-16)18-10-6-12-22-20(18)27-13-14-28(25,26)17-8-2-1-3-9-17/h1-12H,13-15H2,(H,23,24)