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

Systemtic Name: 4-ethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 4-ethyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 4-ethyl-N-[4-(3-pyridinylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 4-ethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 4-ethyl-N-[4-(3-pyridylmethylthio)phenyl]benzenesulfonamide Formula: C20H20N2O2S2 MolecularWeight: 384.515

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C20H20N2O2S2/c1-2-16-5-11-20(12-6-16)26(23,24)22-18-7-9-19(10-8-18)25-15-17-4-3-13-21-14-17/h3-14,22H,2,15H2,1H3