ethyl 3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-(2-oxidanylpropylsulfanyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-(2-oxidanylpropylsulfanyl)benzimidazole-5-carboxylate Openeye Name: ethyl 3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-(2-hydroxypropylsulfanyl)benzimidazole-5-carboxylate CAS Name: 3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-(2-hydroxypropylthio)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-(2-hydroxypropylsulfanyl)benzimidazole-5-carboxylate Traditional Name: 3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-(2-hydroxypropylthio)benzimidazole-5-carboxylic acid ethyl ester Formula: C24H28N2O6S MolecularWeight: 472.55392

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)ON2C3=C(C=CC(=C3)C(=O)OCC)N=C2SCC(C)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)ON2C3=C(C=CC(=C3)C(=O)OCC)N=C2SCC(C)O

InChI

InChI=1S/C24H28N2O6S/c1-5-7-18-21(11-9-17(15(4)28)22(18)29)32-26-20-12-16(23(30)31-6-2)8-10-19(20)25-24(26)33-13-14(3)27/h8-12,14,27,29H,5-7,13H2,1-4H3