5-[2-(2,4-dichlorophenyl)-3-imidazol-1-yl-2-oxidanyl-propyl]sulfanylpentanoic acid

Systemtic Name: 5-[2-(2,4-dichlorophenyl)-3-imidazol-1-yl-2-oxidanyl-propyl]sulfanylpentanoic acid Openeye Name: 5-[2-(2,4-dichlorophenyl)-2-hydroxy-3-imidazol-1-yl-propyl]sulfanylpentanoic acid CAS Name: 5-[[2-(2,4-dichlorophenyl)-2-hydroxy-3-(1-imidazolyl)propyl]thio]pentanoic acid IUPAC Name: 5-[2-(2,4-dichlorophenyl)-2-hydroxy-3-imidazol-1-ylpropyl]sulfanylpentanoic acid Traditional Name: 5-[[2-(2,4-dichlorophenyl)-2-hydroxy-3-imidazol-1-yl-propyl]thio]valeric acid Formula: C17H20Cl2N2O3S MolecularWeight: 403.3233

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)(CSCCCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)(CSCCCCC(=O)O)O

InChI

InChI=1S/C17H20Cl2N2O3S/c18-13-4-5-14(15(19)9-13)17(24,10-21-7-6-20-12-21)11-25-8-2-1-3-16(22)23/h4-7,9,12,24H,1-3,8,10-11H2,(H,22,23)