5,6-dimethyl-4,7-bis(pyridin-1-ium-1-ylmethyl)-2,1,3-benzothiadiazole

Systemtic Name: 5,6-dimethyl-4,7-bis(pyridin-1-ium-1-ylmethyl)-2,1,3-benzothiadiazole Openeye Name: 5,6-dimethyl-4,7-bis(pyridin-1-ium-1-ylmethyl)-2,1,3-benzothiadiazole CAS Name: 5,6-dimethyl-4,7-bis(1-pyridin-1-iumylmethyl)-2,1,3-benzothiadiazole IUPAC Name: 5,6-dimethyl-4,7-bis(pyridin-1-ium-1-ylmethyl)-2,1,3-benzothiadiazole Traditional Name: 5,6-dimethyl-4,7-bis(pyridin-1-ium-1-ylmethyl)piazthiole Formula: C20H20N4S+2 MolecularWeight: 348.4646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NSN=C2C(=C1C)C[N+]3=CC=CC=C3)C[N+]4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=NSN=C2C(=C1C)C[N+]3=CC=CC=C3)C[N+]4=CC=CC=C4

InChI

InChI=1S/C20H20N4S/c1-15-16(2)18(14-24-11-7-4-8-12-24)20-19(21-25-22-20)17(15)13-23-9-5-3-6-10-23/h3-12H,13-14H2,1-2H3/q+2