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

Systemtic Name: 2-chloranyl-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-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=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

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