2-[(4-nitrophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-[(4-nitrophenyl)methylthio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(4-nitrobenzyl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]acetamide Formula: C19H17N5O5S2 MolecularWeight: 459.49878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O5S2/c25-18(13-30-12-14-2-6-16(7-3-14)24(26)27)22-15-4-8-17(9-5-15)31(28,29)23-19-20-10-1-11-21-19/h1-11H,12-13H2,(H,22,25)(H,20,21,23)