4-tert-butyl-N-(5-chloranyl-2-pyridin-4-ylsulfanyl-pyridin-3-yl)benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-(5-chloranyl-2-pyridin-4-ylsulfanyl-pyridin-3-yl)benzenesulfonamide Openeye Name: 4-tert-butyl-N-[5-chloro-2-(4-pyridylsulfanyl)-3-pyridyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[5-chloro-2-(pyridin-4-ylthio)-3-pyridinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-(5-chloro-2-pyridin-4-ylsulfanylpyridin-3-yl)benzenesulfonamide Traditional Name: 4-tert-butyl-N-[5-chloro-2-(4-pyridylthio)-3-pyridyl]benzenesulfonamide Formula: C20H20ClN3O2S2 MolecularWeight: 433.9747

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CN=C2SC3=CC=NC=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CN=C2SC3=CC=NC=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S2/c1-20(2,3)14-4-6-17(7-5-14)28(25,26)24-18-12-15(21)13-23-19(18)27-16-8-10-22-11-9-16/h4-13,24H,1-3H3