2,3,4,5,6-pentamethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 2,3,4,5,6-pentamethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 2,3,4,5,6-pentamethyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 2,3,4,5,6-pentamethyl-N-[4-(3-pyridinylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 2,3,4,5,6-pentamethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 2,3,4,5,6-pentamethyl-N-[4-(3-pyridylmethylthio)phenyl]benzenesulfonamide Formula: C23H26N2O2S2 MolecularWeight: 426.59474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C)C

InChI

InChI=1S/C23H26N2O2S2/c1-15-16(2)18(4)23(19(5)17(15)3)29(26,27)25-21-8-10-22(11-9-21)28-14-20-7-6-12-24-13-20/h6-13,25H,14H2,1-5H3