4-chloranyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Formula: C15H12ClN3O4S2 MolecularWeight: 397.85648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C15H12ClN3O4S2/c1-8-5-9(2)14-13(6-8)24-15(17-14)18-25(22,23)10-3-4-11(16)12(7-10)19(20)21/h3-7H,1-2H3,(H,17,18)