2-bromanyl-4-[(E)-[2-[[3-[(4-chlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylhydrazinylidene]methyl]-6-methoxy-phenolate

Systemtic Name: 2-bromanyl-4-[(E)-[2-[[3-[(4-chlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylhydrazinylidene]methyl]-6-methoxy-phenolate Openeye Name: 2-bromo-4-[(E)-[[2-[[3-[(4-chlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetyl]hydrazono]methyl]-6-methoxy-phenolate CAS Name: 2-bromo-4-[(E)-[[2-[[3-[(4-chlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]thio]-1-oxoethyl]hydrazinylidene]methyl]-6-methoxyphenolate IUPAC Name: 2-bromo-4-[(E)-[[2-[[3-[(4-chlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetyl]hydrazinylidene]methyl]-6-methoxyphenolate Traditional Name: 2-bromo-4-[(E)-[[2-[[3-(4-chlorobenzyl)-1H-benzimidazol-3-ium-2-yl]thio]acetyl]hydrazono]methyl]-6-methoxy-phenolate Formula: C24H20BrClN4O3S MolecularWeight: 559.8626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CSC2=[N+](C3=CC=CC=C3N2)CC4=CC=C(C=C4)Cl)Br)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)CSC2=[N+](C3=CC=CC=C3N2)CC4=CC=C(C=C4)Cl)Br)[O-]

InChI

InChI=1S/C24H20BrClN4O3S/c1-33-21-11-16(10-18(25)23(21)32)12-27-29-22(31)14-34-24-28-19-4-2-3-5-20(19)30(24)13-15-6-8-17(26)9-7-15/h2-12H,13-14H2,1H3,(H2,27,29,31,32)