N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]ethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl]piazthiole-4-sulfonamide Formula: C23H21N5O2S4 MolecularWeight: 527.70514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCNS(=O)(=O)C2=CC=CC3=NSN=C32)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C(C=CC=C1SCCNS(=O)(=O)C2=CC=CC3=NSN=C32)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H21N5O2S4/c1-15-16(14-32-23-25-17-7-2-3-8-18(17)26-23)6-4-10-20(15)31-13-12-24-34(29,30)21-11-5-9-19-22(21)28-33-27-19/h2-11,24H,12-14H2,1H3,(H,25,26)