[4-[(E)-[(1-ethyl-2-methyl-benzimidazol-5-yl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-[(E)-[(1-ethyl-2-methyl-benzimidazol-5-yl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[(E)-[(1-ethyl-2-methyl-benzimidazole-5-carbonyl)hydrazono]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[(E)-[[(1-ethyl-2-methyl-5-benzimidazolyl)-oxomethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(1-ethyl-2-methylbenzimidazole-5-carbonyl)hydrazinylidene]methyl]-2-methoxyphenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[(E)-[(1-ethyl-2-methyl-benzimidazole-5-carbonyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C27H28N4O5S MolecularWeight: 520.60002

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)NN=CC3=CC(=C(C=C3)OS(=O)(=O)C4=C(C=CC(=C4)C)C)OC)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)N/N=C/C3=CC(=C(C=C3)OS(=O)(=O)C4=C(C=CC(=C4)C)C)OC)C

InChI

InChI=1S/C27H28N4O5S/c1-6-31-19(4)29-22-15-21(10-11-23(22)31)27(32)30-28-16-20-9-12-24(25(14-20)35-5)36-37(33,34)26-13-17(2)7-8-18(26)3/h7-16H,6H2,1-5H3,(H,30,32)/b28-16+