2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]ethanamide Openeye Name: N-[[3-(isopropylsulfamoyl)phenyl]methyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]acetamide Traditional Name: N-[3-(isopropylsulfamoyl)benzyl]-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC(=C1)CNC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC(=C1)CNC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O6S2/c1-14(2)22-31(27,28)17-6-4-5-15(9-17)11-21-20(24)13-30-12-16-7-8-19(29-3)18(10-16)23(25)26/h4-10,14,22H,11-13H2,1-3H3,(H,21,24)