[2-methoxy-4-[[2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylhydrazinylidene]methyl]phenyl] ethanoate

Systemtic Name: [2-methoxy-4-[[2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylhydrazinylidene]methyl]phenyl] ethanoate Openeye Name: [4-[[[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetyl]hydrazono]methyl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [2-methoxy-4-[[[1-oxo-2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]thio]ethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[[[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[[[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)thio]acetyl]hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C26H25N4O4S+ MolecularWeight: 489.5661

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=NNC(=O)CSC2=[N+](C3=CC=CC=C3N2)CC4=CC=CC=C4)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C=NNC(=O)CSC2=[N+](C3=CC=CC=C3N2)CC4=CC=CC=C4)OC

InChI

InChI=1S/C26H24N4O4S/c1-18(31)34-23-13-12-20(14-24(23)33-2)15-27-29-25(32)17-35-26-28-21-10-6-7-11-22(21)30(26)16-19-8-4-3-5-9-19/h3-15H,16-17H2,1-2H3,(H,29,32)/p+1