2-[(2-methylphenyl)methylsulfanyl]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(o-tolylmethylsulfanyl)-N-[4-(3-pyridylsulfamoyl)phenyl]acetamide CAS Name: 2-[(2-methylphenyl)methylthio]-N-[4-(3-pyridinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(2-methylbenzyl)thio]-N-[4-(3-pyridylsulfamoyl)phenyl]acetamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CN=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c1-16-5-2-3-6-17(16)14-28-15-21(25)23-18-8-10-20(11-9-18)29(26,27)24-19-7-4-12-22-13-19/h2-13,24H,14-15H2,1H3,(H,23,25)