4-(diethylsulfamoyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]benzamide

Systemtic Name: 4-(diethylsulfamoyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]benzamide Openeye Name: 4-(diethylsulfamoyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]benzamide CAS Name: 4-(diethylsulfamoyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]benzamide IUPAC Name: 4-(diethylsulfamoyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]benzamide Traditional Name: 4-(diethylsulfamoyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]benzamide Formula: C21H24N4O6S2 MolecularWeight: 492.56846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])CCOC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])CCOC

InChI

InChI=1S/C21H24N4O6S2/c1-4-23(5-2)33(29,30)17-9-6-15(7-10-17)20(26)22-21-24(12-13-31-3)18-14-16(25(27)28)8-11-19(18)32-21/h6-11,14H,4-5,12-13H2,1-3H3