3-bromanyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 3-bromo-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 3-bromo-N-[4-(3-pyridinylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 3-bromo-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 3-bromo-N-[4-(3-pyridylmethylthio)phenyl]benzenesulfonamide Formula: C18H15BrN2O2S2 MolecularWeight: 435.3579

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C18H15BrN2O2S2/c19-15-4-1-5-18(11-15)25(22,23)21-16-6-8-17(9-7-16)24-13-14-3-2-10-20-12-14/h1-12,21H,13H2