N-[3-(dimethylsulfamoyl)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[3-(dimethylsulfamoyl)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[3-(dimethylsulfamoyl)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[3-(dimethylsulfamoyl)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[3-(dimethylsulfamoyl)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[3-(dimethylsulfamoyl)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C17H16N6O5S MolecularWeight: 416.41114

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N6O5S/c1-21(2)29(27,28)14-5-3-4-13(9-14)20-17(24)12-6-7-15(16(8-12)23(25)26)22-11-18-10-19-22/h3-11H,1-2H3,(H,20,24)