N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(methylthio)-3-nitro-benzamide Formula: C21H19N3O5S2 MolecularWeight: 457.52266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O5S2/c1-23(17-8-4-3-5-9-17)31(28,29)18-10-6-7-16(14-18)22-21(25)15-11-12-20(30-2)19(13-15)24(26)27/h3-14H,1-2H3,(H,22,25)