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

Systemtic Name: ethyl 1-[5-(3,4-dimethylphenyl)sulfanyl-2-oxidanyl-pentyl]imidazole-4-carboxylate Openeye Name: ethyl 1-[5-(3,4-dimethylphenyl)sulfanyl-2-hydroxy-pentyl]imidazole-4-carboxylate CAS Name: 1-[5-[(3,4-dimethylphenyl)thio]-2-hydroxypentyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(3,4-dimethylphenyl)sulfanyl-2-hydroxypentyl]imidazole-4-carboxylate Traditional Name: 1-[5-[(3,4-dimethylphenyl)thio]-2-hydroxy-pentyl]imidazole-4-carboxylic acid ethyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O3S/c1-4-24-19(23)18-12-21(13-20-18)11-16(22)6-5-9-25-17-8-7-14(2)15(3)10-17/h7-8,10,12-13,16,22H,4-6,9,11H2,1-3H3