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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CN=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c25-21(12-14-28-16-17-5-2-1-3-6-17)23-18-8-10-20(11-9-18)29(26,27)24-19-7-4-13-22-15-19/h1-11,13,15,24H,12,14,16H2,(H,23,25)