[1-imidazol-1-yl-3,3-dimethyl-1-(4-methylsulfanylphenoxy)butan-2-yl] ethanoate

Systemtic Name: [1-imidazol-1-yl-3,3-dimethyl-1-(4-methylsulfanylphenoxy)butan-2-yl] ethanoate Openeye Name: [1-[imidazol-1-yl-(4-methylsulfanylphenoxy)methyl]-2,2-dimethyl-propyl] acetate CAS Name: acetic acid [1-(1-imidazolyl)-3,3-dimethyl-1-[4-(methylthio)phenoxy]butan-2-yl] ester IUPAC Name: [1-imidazol-1-yl-3,3-dimethyl-1-(4-methylsulfanylphenoxy)butan-2-yl] acetate Traditional Name: acetic acid [1-[imidazol-1-yl-[4-(methylthio)phenoxy]methyl]-2,2-dimethyl-propyl] ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(N1C=CN=C1)OC2=CC=C(C=C2)SC)C(C)(C)C

Isomeric SMILES

CC(=O)OC(C(N1C=CN=C1)OC2=CC=C(C=C2)SC)C(C)(C)C

InChI

InChI=1S/C18H24N2O3S/c1-13(21)22-16(18(2,3)4)17(20-11-10-19-12-20)23-14-6-8-15(24-5)9-7-14/h6-12,16-17H,1-5H3