2-[(E)-[2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 2-[(E)-[2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 2-[(E)-[[2-(1-benzylbenzimidazol-2-yl)sulfanylacetyl]hydrazono]methyl]benzoic acid CAS Name: 2-[(E)-[[1-oxo-2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]ethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 2-[(E)-[[2-(1-benzylbenzimidazol-2-yl)sulfanylacetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 2-[(E)-[[2-[(1-benzylbenzimidazol-2-yl)thio]acetyl]hydrazono]methyl]benzoic acid Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)N/N=C/C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C24H20N4O3S/c29-22(27-25-14-18-10-4-5-11-19(18)23(30)31)16-32-24-26-20-12-6-7-13-21(20)28(24)15-17-8-2-1-3-9-17/h1-14H,15-16H2,(H,27,29)(H,30,31)/b25-14+