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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C

InChI

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