5-methyl-4-[[2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium-3-yl]sulfonyl]-2,1,3-benzothiadiazole

Systemtic Name: 5-methyl-4-[[2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium-3-yl]sulfonyl]-2,1,3-benzothiadiazole Openeye Name: 4-[(2-benzyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)sulfonyl]-5-methyl-2,1,3-benzothiadiazole CAS Name: 5-methyl-4-[[2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium-3-yl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[(2-benzyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)sulfonyl]-5-methyl-2,1,3-benzothiadiazole Traditional Name: 4-[(2-benzyl-2-imidazolin-1-ium-1-yl)sulfonyl]-5-methyl-piazthiole Formula: C17H17N4O2S2+ MolecularWeight: 373.47248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)[N+]3=C(NCC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)[N+]3=C(NCC3)CC4=CC=CC=C4

InChI

InChI=1S/C17H16N4O2S2/c1-12-7-8-14-16(20-24-19-14)17(12)25(22,23)21-10-9-18-15(21)11-13-5-3-2-4-6-13/h2-8H,9-11H2,1H3/p+1