ethyl 1-[5-(3,4-dichlorophenyl)sulfanyl-2-oxidanyl-pentyl]imidazole-4-carboxylate

Systemtic Name: ethyl 1-[5-(3,4-dichlorophenyl)sulfanyl-2-oxidanyl-pentyl]imidazole-4-carboxylate Openeye Name: ethyl 1-[5-(3,4-dichlorophenyl)sulfanyl-2-hydroxy-pentyl]imidazole-4-carboxylate CAS Name: 1-[5-[(3,4-dichlorophenyl)thio]-2-hydroxypentyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(3,4-dichlorophenyl)sulfanyl-2-hydroxypentyl]imidazole-4-carboxylate Traditional Name: 1-[5-[(3,4-dichlorophenyl)thio]-2-hydroxy-pentyl]imidazole-4-carboxylic acid ethyl ester Formula: C17H20Cl2N2O3S MolecularWeight: 403.3233

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=N1)CC(CCCSC2=CC(=C(C=C2)Cl)Cl)O

Isomeric SMILES

CCOC(=O)C1=CN(C=N1)CC(CCCSC2=CC(=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C17H20Cl2N2O3S/c1-2-24-17(23)16-10-21(11-20-16)9-12(22)4-3-7-25-13-5-6-14(18)15(19)8-13/h5-6,8,10-12,22H,2-4,7,9H2,1H3