2-chloranyl-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide Formula: C16H13ClN4O5S2 MolecularWeight: 440.88122

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H13ClN4O5S2/c1-20(2)28(25,26)10-4-6-13-14(8-10)27-16(18-13)19-15(22)11-7-9(21(23)24)3-5-12(11)17/h3-8H,1-2H3,(H,18,19,22)