2-(3,4-dimethoxyphenyl)sulfanyl-N-[4-(pyridin-3-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-[4-(pyridin-3-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-[4-(3-pyridylsulfamoyl)phenyl]acetamide CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-N-[4-(3-pyridinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-[4-(pyridin-3-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-N-[4-(3-pyridylsulfamoyl)phenyl]acetamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CN=CC=C3)OC

InChI

InChI=1S/C21H21N3O5S2/c1-28-19-10-7-17(12-20(19)29-2)30-14-21(25)23-15-5-8-18(9-6-15)31(26,27)24-16-4-3-11-22-13-16/h3-13,24H,14H2,1-2H3,(H,23,25)