(4-bromanyl-2,1,3-benzothiadiazol-5-yl)-dimethyl-(5-sulfamoylnaphthalen-1-yl)azanium

Systemtic Name: (4-bromanyl-2,1,3-benzothiadiazol-5-yl)-dimethyl-(5-sulfamoylnaphthalen-1-yl)azanium Openeye Name: (4-bromo-2,1,3-benzothiadiazol-5-yl)-dimethyl-(5-sulfamoyl-1-naphthyl)ammonium CAS Name: (4-bromo-2,1,3-benzothiadiazol-5-yl)-dimethyl-(5-sulfamoyl-1-naphthalenyl)ammonium IUPAC Name: (4-bromo-2,1,3-benzothiadiazol-5-yl)-dimethyl-(5-sulfamoylnaphthalen-1-yl)azanium Traditional Name: (4-bromopiazthiol-5-yl)-dimethyl-(5-sulfamoyl-1-naphthyl)ammonium Formula: C18H16BrN4O2S2+ MolecularWeight: 464.37924

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=C(C2=NSN=C2C=C1)Br)C3=CC=CC4=C3C=CC=C4S(=O)(=O)N

Isomeric SMILES

C[N+](C)(C1=C(C2=NSN=C2C=C1)Br)C3=CC=CC4=C3C=CC=C4S(=O)(=O)N

InChI

InChI=1S/C18H16BrN4O2S2/c1-23(2,15-10-9-13-18(17(15)19)22-26-21-13)14-7-3-6-12-11(14)5-4-8-16(12)27(20,24)25/h3-10H,1-2H3,(H2,20,24,25)/q+1