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

Systemtic Name: 2-chloranyl-N-[6-[di(propan-2-yl)sulfamoyl]-1,3-benzothiazol-2-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[6-(diisopropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[6-[di(propan-2-yl)sulfamoyl]-1,3-benzothiazol-2-yl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[6-[di(propan-2-yl)sulfamoyl]-1,3-benzothiazol-2-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[6-(diisopropylsulfamoyl)-1,3-benzothiazol-2-yl]-5-nitro-benzamide Formula: C20H21ClN4O5S2 MolecularWeight: 496.98754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)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

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