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

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[4-(pyridin-3-ylsulfamoyl)phenyl]propanamide Openeye Name: 2-benzylsulfanyl-N-[4-(3-pyridylsulfamoyl)phenyl]propanamide CAS Name: 2-(phenylmethylthio)-N-[4-(3-pyridinylsulfamoyl)phenyl]propanamide IUPAC Name: 2-benzylsulfanyl-N-[4-(pyridin-3-ylsulfamoyl)phenyl]propanamide Traditional Name: 2-(benzylthio)-N-[4-(3-pyridylsulfamoyl)phenyl]propionamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CN=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CN=CC=C2)SCC3=CC=CC=C3

InChI

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