3-(4-methylphenyl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-(4-methylphenyl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-(p-tolylsulfanyl)-N-[4-(2-pyridylsulfamoyl)phenyl]propanamide CAS Name: 3-[(4-methylphenyl)thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(4-methylphenyl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-(p-tolylthio)-N-[4-(2-pyridylsulfamoyl)phenyl]propionamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

InChI

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