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

Systemtic Name: 4-chloranyl-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitro-benzamide Formula: C20H21ClN4O5S2 MolecularWeight: 496.98754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O5S2/c1-3-9-24(10-4-2)32(29,30)14-6-8-16-18(12-14)31-20(22-16)23-19(26)13-5-7-15(21)17(11-13)25(27)28/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,23,26)