5-bromanyl-2-ethoxy-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 5-bromo-2-ethoxy-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 5-bromo-2-ethoxy-N-[4-(3-pyridinylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 5-bromo-2-ethoxy-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 5-bromo-2-ethoxy-N-[4-(3-pyridylmethylthio)phenyl]benzenesulfonamide Formula: C20H19BrN2O3S2 MolecularWeight: 479.41046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C20H19BrN2O3S2/c1-2-26-19-10-5-16(21)12-20(19)28(24,25)23-17-6-8-18(9-7-17)27-14-15-4-3-11-22-13-15/h3-13,23H,2,14H2,1H3